data_2lrt_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2lrt _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 121.166 0.508 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.512 ' O ' HD11 ' A' ' 30' ' ' LEU . 3.9 mp -95.95 122.81 47.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.555 175.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.4 ' OD1' ' HB2' ' A' ' 29' ' ' SER . 26.2 t70 -87.08 106.17 17.68 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.675 ' O ' ' HA ' ' A' ' 29' ' ' SER . 13.0 mt -89.4 110.2 21.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.457 -173.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.498 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 34.3 mt-30 -105.59 100.03 9.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.196 0.522 . . . . 0.0 110.776 -178.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' A' ' 97' ' ' ASP . 32.7 mt -140.22 151.01 44.84 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 174.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.654 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.9 mttm -90.89 155.34 18.82 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.037 -173.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.549 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 15.2 p30 -91.76 -172.6 3.26 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.03 -175.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.77 HD11 ' HA ' ' A' ' 84' ' ' LYS . 21.2 tp -57.31 -27.38 62.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.319 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 68.0 mttm -96.05 -12.5 24.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.062 0.458 . . . . 0.0 111.026 -175.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.91 -3.34 31.86 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.38 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.552 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 17.9 m-80 -72.26 118.76 15.55 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.654 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.6 m -73.08 106.21 4.85 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.209 -177.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.425 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 16.5 mmt180 -87.81 142.14 28.05 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.742 -177.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.675 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 31.9 p -135.33 159.76 40.55 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.817 ' HB3' HD22 ' A' ' 124' ' ' ASN . 47.0 mt -72.72 -21.35 61.05 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.446 0.641 . . . . 0.0 110.004 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.405 ' HA ' ' NZ ' ' A' ' 34' ' ' LYS . 3.6 p -73.17 -15.5 61.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.144 172.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t70 -87.37 -40.12 14.7 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.751 0.786 . . . . 0.0 109.467 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.702 HD23 HG13 ' A' ' 38' ' ' VAL . 7.8 tp -86.6 15.81 5.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.281 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.669 ' HZ1' ' HB2' ' A' ' 34' ' ' LYS . 4.4 ttmp? -66.76 -11.17 53.76 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.332 0.587 . . . . 0.0 111.517 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.21 -20.58 71.32 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.625 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.663 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 76.7 mttt -129.95 178.8 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.777 HG21 ' HD1' ' A' ' 69' ' ' PHE . 19.6 m -81.02 129.0 38.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 166.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.702 HG13 HD23 ' A' ' 33' ' ' LEU . 24.1 t -101.68 121.62 52.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.123 0.487 . . . . 0.0 111.868 -168.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.5 tp -88.41 116.18 26.46 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.366 173.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.537 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 10.0 mm -90.08 105.25 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.48 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 10.3 t70 -106.99 130.3 54.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.922 0.391 . . . . 0.0 110.902 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.68 ' HB3' HD12 ' A' ' 76' ' ' LEU . 66.5 m-85 -121.3 100.74 7.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.839 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 t -146.64 176.39 9.87 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.625 -178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.473 HG23 ' HB2' ' A' ' 47' ' ' ASN . 5.2 m -111.06 119.49 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.135 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.711 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 43.8 m-85 -74.42 83.52 1.96 Allowed 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 173.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 177.45 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.933 0.873 . . . . 0.0 109.791 -168.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.473 ' HB2' HG23 ' A' ' 44' ' ' VAL . 9.0 t-20 -95.04 142.52 27.42 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.06 -1.427 . . . . 0.0 110.837 -167.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -29.53 66.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.437 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.9 ptp -65.98 -22.08 66.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.011 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 t -73.33 -29.73 62.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.54 -52.17 62.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.119 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.26 -37.0 80.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.746 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.464 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 78.6 t60 -64.84 -36.79 85.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.394 178.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.532 ' HA ' HD12 ' A' ' 57' ' ' LEU . 21.5 t-20 -67.17 -32.14 73.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.751 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tt -65.45 -42.74 92.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.972 0.415 . . . . 0.0 109.925 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.87 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.298 0.57 . . . . 0.0 110.368 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 54' ' ' ASN . 62.7 mt -69.03 -40.46 78.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.757 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -60.48 -30.12 69.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.192 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -76.4 -52.03 10.69 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.842 HD12 HD13 ' A' ' 140' ' ' ILE . 2.2 mm? -57.43 -27.84 62.76 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 112.681 -2.054 . . . . 0.0 111.415 178.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -76.29 -46.57 27.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.007 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.4 -22.18 65.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.247 0.546 . . . . 0.0 110.547 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.528 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 37.3 mttm -77.39 -61.16 2.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.035 -179.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.44 ' CZ ' ' HB2' ' A' ' 141' ' ' LYS . 95.8 m-85 -115.17 -8.05 12.4 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -164.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.547 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.89 -36.05 76.14 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.176 0.444 . . . . 0.0 111.491 -176.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.0 m -64.43 -19.99 65.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.646 -178.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -102.98 2.39 34.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.678 0.275 . . . . 0.0 111.267 -176.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 112.54 55.58 0.46 Allowed Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.567 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.777 ' HD1' HG21 ' A' ' 37' ' ' VAL . 31.4 t80 -131.54 143.33 50.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.663 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.75 148.24 38.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.976 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.526 HD11 ' CE3' ' A' ' 92' ' ' TRP . 56.9 mt -107.69 117.86 54.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.144 0.497 . . . . 0.0 110.066 176.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -99.32 99.32 10.25 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.48 ' HG3' ' HB3' ' A' ' 41' ' ' ASP . 43.9 tt0 -102.45 123.77 46.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.14 -172.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 49.6 mt -105.69 125.24 61.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.612 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.711 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 4.0 p -84.95 121.91 28.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.786 176.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.68 HD12 ' HB3' ' A' ' 42' ' ' PHE . 16.8 mt -106.52 5.74 29.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.284 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.488 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.1 p-10 -68.81 -60.93 2.04 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.162 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.55 32.73 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -178.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.476 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 33.8 t70 -113.16 104.18 12.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.375 0.607 . . . . 0.0 110.728 -178.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.476 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 31.0 mt-10 -68.78 -14.35 62.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.934 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . 0.476 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 61.0 m80 -66.49 -59.35 3.73 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.624 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -74.43 -34.46 63.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.276 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -60.8 -53.38 58.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.955 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.77 ' HA ' HD11 ' A' ' 23' ' ' LEU . 19.3 ttmt -63.87 -41.62 97.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.689 0.281 . . . . 0.0 111.391 -173.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -69.75 -41.46 75.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.84 0.353 . . . . 0.0 111.548 -177.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -75.54 -47.56 26.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.369 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.643 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -67.79 -27.16 66.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.833 -174.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -58.54 -27.26 64.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.25 0.548 . . . . 0.0 111.429 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -108.67 13.0 25.44 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.773 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.7 mt -90.37 144.69 31.27 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 111.718 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.59 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 60.5 Cg_endo -70.25 -52.81 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.688 2.925 . . . . 0.0 113.518 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.59 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.8 p90 -87.41 -169.02 2.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.144 -171.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.8 t -80.96 126.83 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.849 -173.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.643 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 2.0 p -123.73 108.65 12.76 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.508 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.548 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 19.7 m -121.43 172.17 8.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.233 -178.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -125.57 144.36 50.6 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.984 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.493 ' HA ' HD11 ' A' ' 20' ' ' LEU . 19.8 t70 -81.6 168.74 17.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.903 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.28 -38.33 27.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.252 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.408 ' CG ' ' HB2' ' A' ' 102' ' ' TYR . 7.3 t-20 -122.97 -11.77 8.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.008 0.432 . . . . 0.0 111.339 -175.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.535 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 78.64 -108.91 2.74 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.472 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.01 -23.94 64.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.079 0.466 . . . . 0.0 110.858 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.408 ' HB2' ' CG ' ' A' ' 99' ' ' ASN . 55.6 m-85 -99.08 29.16 4.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.804 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.501 ' HB3' HG13 ' A' ' 106' ' ' ILE . 37.1 t -60.15 140.0 57.19 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.507 -178.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.55 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.5 m -63.36 -31.26 72.37 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.745 174.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -67.19 -48.82 66.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.995 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.556 HD12 HD11 ' A' ' 76' ' ' LEU . 58.9 mt -53.71 -38.03 33.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.623 175.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 20.4 m -68.61 -39.56 80.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.742 177.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.8 mt -68.59 -38.72 80.9 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.62 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.53 ' OH ' HD12 ' A' ' 18' ' ' ILE . 89.1 m-85 -69.8 -30.56 68.13 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.818 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.461 0.121 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -165.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.46 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 3.6 mm? . . . . . 0 CA--C 1.537 0.478 0 CA-C-O 121.059 0.457 . . . . 0.0 111.708 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.46 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 52.7 Cg_endo -70.56 162.09 87.1 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.239 -1.567 . . . . 0.0 111.716 -0.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.6 t -147.89 176.66 9.97 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.221 0.534 . . . . 0.0 110.748 -176.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.494 HG11 ' HA3' ' A' ' 130' ' ' GLY . 2.8 p -142.82 154.7 17.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 175.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.537 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.3 m-85 -143.3 158.17 43.86 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.948 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.5 tp -112.33 143.87 42.7 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.64 -173.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 2.8 t -140.95 131.69 27.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.035 172.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.564 ' HB3' HD22 ' A' ' 143' ' ' LEU . 3.9 p-10 -96.62 176.98 5.81 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.366 176.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.442 ' C ' ' H ' ' A' ' 124' ' ' ASN . 84.0 mtt-85 -43.33 -42.56 4.59 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -166.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . 0.537 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 75.3 m-20 -78.95 12.73 2.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 121.995 -0.441 . . . . 0.0 110.457 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.817 HD22 ' HB3' ' A' ' 30' ' ' LEU . 2.3 t-20 61.18 44.12 10.32 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.487 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.537 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 87.4 mt-10 -96.23 133.13 40.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.288 177.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.7 tt -72.34 107.94 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.948 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 63.8 m -71.66 -55.49 7.62 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.291 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 178.95 173.04 0.77 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.037 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.559 ' HD3' ' OE2' ' A' ' 131' ' ' GLU . 76.4 mtt180 -83.3 159.28 21.93 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.745 176.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.494 ' HA3' HG11 ' A' ' 117' ' ' VAL . . . -62.81 -34.33 89.47 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 111.747 -0.541 . . . . 0.0 111.747 175.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.559 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 2.0 mp0 -64.19 -25.39 68.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.248 0.547 . . . . 0.0 110.356 177.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -90.69 -26.86 19.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.315 0.579 . . . . 0.0 110.194 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.577 ' CD1' ' HB2' ' A' ' 119' ' ' LEU . 23.4 mt -99.11 94.79 3.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.147 -175.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.17 11.71 24.67 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.227 173.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -143.43 41.4 1.47 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.283 -170.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.55 ' O ' HG13 ' A' ' 140' ' ' ILE . 3.7 mp -53.66 -35.37 60.95 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -176.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.6 ' HA ' HD11 ' A' ' 60' ' ' LEU . 24.0 t70 -54.53 -58.41 7.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.738 0.304 . . . . 0.0 110.551 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.605 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 4.4 mm-40 -65.68 -32.61 74.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 111.916 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.705 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.68 -56.01 24.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.618 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.842 HD13 HD12 ' A' ' 60' ' ' LEU . 48.2 mt -61.47 -34.98 63.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.143 0.497 . . . . 0.0 110.108 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 64' ' ' TYR . 25.6 tttm -60.0 -53.41 58.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.896 176.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' A' ' 138' ' ' GLU . 13.8 pttm -67.27 -27.34 67.12 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.705 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 48.3 mt -64.22 -42.12 96.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.669 0.747 . . . . 0.0 110.027 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.425 HD21 ' NH2' ' A' ' 122' ' ' ARG . 88.0 mt . . . . . 0 C--N 1.322 -0.615 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.987 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.501 HG23 ' O ' ' A' ' 124' ' ' ASN . 9.4 pt . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.546 ' O ' HD13 ' A' ' 30' ' ' LEU . 79.5 mt -121.66 103.52 13.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 174.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -104.23 130.81 52.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.516 HG22 ' HG ' ' A' ' 20' ' ' LEU . 14.6 mt -116.76 121.47 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.228 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.515 ' HG3' ' HB3' ' A' ' 29' ' ' SER . 1.7 mp0 -98.08 101.75 13.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.732 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.516 ' HG ' HG22 ' A' ' 18' ' ' ILE . 33.7 mt -132.03 155.6 47.74 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 50.7 mttm -86.94 151.07 23.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.934 0.397 . . . . 0.0 110.793 178.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.627 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -85.39 -177.53 6.49 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.404 175.075 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.651 ' CD2' ' HA ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -53.89 -36.73 63.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.546 0.689 . . . . 0.0 112.005 179.346 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.5 mttp -78.22 -18.91 54.8 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.718 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 107.69 9.28 28.97 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.474 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.404 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 42.5 m-80 -81.57 108.86 15.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.479 0.18 . . . . 0.0 110.899 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.579 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 62.6 m -68.32 110.22 3.98 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.452 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 5.8 mmm180 -104.38 130.71 52.23 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.991 0.424 . . . . 0.0 110.329 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.515 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 45.7 p -104.31 159.04 16.04 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 169.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.546 HD13 ' O ' ' A' ' 16' ' ' ILE . 50.7 mt -69.6 -26.0 64.24 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.487 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.4 p -68.55 -16.29 63.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.73 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -78.55 -24.83 45.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 122.295 1.045 . . . . 0.0 108.913 176.788 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.589 HD22 HG13 ' A' ' 38' ' ' VAL . 1.5 tp -99.18 6.08 46.54 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.133 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.525 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 51.0 tttm -69.77 144.53 52.67 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -176.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.73 -21.46 43.79 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 1.132 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 10.0 ttmt -124.07 155.8 37.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.425 -0.887 . . . . 0.0 108.859 178.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.76 HG21 ' HD1' ' A' ' 69' ' ' PHE . 26.9 m -81.59 140.3 16.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -176.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.589 HG13 HD22 ' A' ' 33' ' ' LEU . 32.2 t -122.56 129.02 75.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.27 0.557 . . . . 0.0 111.9 -169.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.598 HD22 HG22 ' A' ' 71' ' ' ILE . 7.0 tt -91.65 112.62 24.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.035 172.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.565 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 15.7 mm -91.03 105.75 16.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.235 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -109.67 139.77 44.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.987 0.423 . . . . 0.0 111.244 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.5 102.43 7.38 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.474 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.9 t -139.63 164.33 30.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.989 0.423 . . . . 0.0 111.62 -174.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.643 HG13 ' HA ' ' A' ' 77' ' ' ASP . 3.3 m -106.47 126.68 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.243 176.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.57 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 21.5 m-85 -87.8 83.42 7.13 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 -177.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.52 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 3.9 m-20 177.14 -50.03 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 114.666 -1.152 . . . . 0.0 108.585 -177.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.55 ' HB3' HG21 ' A' ' 44' ' ' VAL . 3.1 t30 -70.26 133.13 46.71 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.285 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.88 -24.63 38.29 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.557 -173.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.6 mtt -59.76 -26.69 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.851 177.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -75.8 -40.97 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.432 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.47 -59.25 5.26 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.771 -175.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.89 71.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.707 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.484 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 t60 -65.19 -45.37 85.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.793 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.499 ' HA ' HD12 ' A' ' 57' ' ' LEU . 89.5 m-20 -69.07 -25.21 64.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.154 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.6 tt -73.09 -44.9 59.79 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.52 -35.34 74.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.36 0.6 . . . . 0.0 110.03 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -67.07 -37.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.867 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.409 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 10.1 tpp180 -60.95 -28.31 68.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.497 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -77.99 -53.75 7.07 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 122.666 1.222 . . . . 0.0 107.879 -177.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.758 HD11 HD12 ' A' ' 140' ' ' ILE . 2.4 mm? -55.36 -29.1 57.74 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 112.282 -2.235 . . . . 0.0 111.506 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -75.54 -48.29 23.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.912 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -61.71 -21.89 64.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.251 0.548 . . . . 0.0 110.431 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -80.35 -57.57 3.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.319 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -108.17 -5.59 16.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -167.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -70.63 178.69 2.9 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.867 178.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.5 m 71.61 -35.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.326 0.65 . . . . 0.0 111.602 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.455 ' H ' ' C ' ' A' ' 65' ' ' ALA . 50.6 mt-30 -79.45 -0.49 33.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 111.114 178.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.575 ' O ' HG23 ' A' ' 37' ' ' VAL . . . 110.71 47.53 0.78 Allowed Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.907 -0.664 . . . . 0.0 111.896 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.76 ' HD1' HG21 ' A' ' 37' ' ' VAL . 65.4 t80 -129.57 141.2 51.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.55 0.214 . . . . 0.0 110.872 -179.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 1.132 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.1 tp10 -137.38 153.32 50.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.14 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.598 HG22 HD22 ' A' ' 39' ' ' LEU . 47.8 mt -111.9 124.77 68.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 173.026 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.452 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.1 t80 -109.69 100.92 9.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.204 0.526 . . . . 0.0 109.884 -177.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.704 ' HB2' ' HA ' ' A' ' 94' ' ' CYS . 15.9 mm100 -83.33 125.97 32.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.263 -178.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.8 mt -111.71 111.1 34.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 43' ' ' THR . 53.5 p -92.62 115.03 27.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.98 0.419 . . . . 0.0 110.815 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.704 HD12 HD22 ' A' ' 114' ' ' LEU . 0.5 OUTLIER -109.21 29.05 7.88 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.099 0.476 . . . . 0.0 110.106 177.507 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.643 ' HA ' HG13 ' A' ' 44' ' ' VAL . 16.8 t70 -73.41 -77.67 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.572 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.17 -31.13 2.38 Favored Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.872 -178.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -81.61 135.97 35.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.165 0.507 . . . . 0.0 111.763 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -79.34 -52.14 8.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.963 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -66.71 -29.7 69.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -165.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -88.63 -40.05 13.61 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.474 ' CZ2' ' HG ' ' A' ' 23' ' ' LEU . 28.5 t90 -57.51 -47.62 81.46 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.326 172.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.651 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 14.2 mtpp -65.66 -47.71 74.61 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -176.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.5 p -63.92 -38.52 91.38 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.318 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.438 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 16.8 m -78.71 -42.72 27.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.135 -177.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.567 ' HB1' HD23 ' A' ' 23' ' ' LEU . . . -88.53 -33.46 17.74 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -169.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.506 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 2.0 t0 -73.43 -12.19 60.72 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 110.017 -174.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -101.99 13.49 34.61 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.011 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.47 HD12 ' HA ' ' A' ' 87' ' ' ALA . 53.6 mt -96.69 150.33 36.84 Favored Pre-proline 0 N--CA 1.447 -0.592 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.525 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.692 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.2 Cg_endo -74.02 -42.39 0.77 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.991 3.127 . . . . 0.0 113.125 -177.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.692 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.7 p90 -90.15 -167.43 1.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.37 -171.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.0 t -81.69 130.79 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.158 -174.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.704 ' HA ' ' HB2' ' A' ' 73' ' ' GLN . 53.1 m -133.52 102.13 5.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.889 0.376 . . . . 0.0 110.233 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.627 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.0 m -114.15 173.25 3.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.761 -175.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -124.34 136.19 53.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.785 0.326 . . . . 0.0 111.611 -177.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -72.35 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.396 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.32 -25.46 33.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.1 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -97.75 -12.33 22.39 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.861 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 61.78 66.07 2.85 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.616 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.456 ' HB3' HD13 ' A' ' 76' ' ' LEU . . . 77.81 -16.11 0.69 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.397 0.679 . . . . 0.0 111.749 177.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -92.05 19.47 6.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.208 0.528 . . . . 0.0 109.712 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.513 ' HB3' HG13 ' A' ' 106' ' ' ILE . 9.2 t -72.81 129.76 38.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.123 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 3.8 p -62.09 -30.88 71.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.458 -177.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.464 ' HA ' HD13 ' A' ' 108' ' ' LEU . 55.6 m-85 -61.55 -34.54 75.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.518 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.513 HG13 ' HB3' ' A' ' 103' ' ' SER . 65.6 mt -58.92 -39.28 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.0 0.429 . . . . 0.0 110.478 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.3 m -74.36 -29.06 61.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 177.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 105' ' ' TYR . 94.9 mt -70.57 -25.35 63.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.209 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.45 ' HB3' ' CE2' ' A' ' 118' ' ' PHE . 68.4 m-85 -77.54 -12.81 60.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.23 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.412 HD21 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.15 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -171.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.704 HD22 HD12 ' A' ' 76' ' ' LEU . 2.4 tt . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.685 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 44.3 Cg_exo -51.22 144.04 8.78 Favored 'Cis proline' 0 C--N 1.362 1.261 0 CA-C-N 120.022 1.043 . . . . 0.0 114.079 2.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.9 t -139.05 175.33 9.65 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.799 -173.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.649 HG13 HD12 ' A' ' 136' ' ' LEU . 9.3 p -142.32 152.54 18.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.822 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.62 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 84.1 m-85 -137.81 161.31 36.91 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.995 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.5 tp -110.9 136.76 49.45 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.802 -174.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.461 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 2.9 t -137.85 122.95 24.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 172.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.58 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 10.3 p30 -87.57 176.07 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 119.963 -0.695 . . . . 0.0 109.728 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.495 HH12 ' HA ' ' A' ' 144' ' ' LEU . 22.9 ptt-85 -64.12 -9.79 18.69 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -165.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . 0.544 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 66.4 t30 -88.36 7.32 33.09 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.452 -0.78 . . . . 0.0 109.518 174.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.525 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 0.1 OUTLIER 74.83 24.45 1.6 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.914 -178.176 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.58 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 84.7 mt-10 -91.45 116.05 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.576 -172.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 119' ' ' LEU . 1.6 tm? -59.56 107.66 0.62 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.584 0.707 . . . . 0.0 109.228 174.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.995 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.4 m -80.99 -56.62 3.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.41 -173.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.25 18.82 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.62 ' HG3' ' CE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -104.26 167.49 9.72 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.963 178.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.09 51.17 Favored Glycine 0 CA--C 1.52 0.395 0 N-CA-C 114.546 0.579 . . . . 0.0 114.546 -174.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -21.7 46.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.286 0.543 . . . . 0.0 110.328 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.402 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -71.5 -36.17 71.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.693 173.772 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.525 HD13 ' HB2' ' A' ' 119' ' ' LEU . 96.3 mt -69.53 129.86 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.831 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.99 95.61 5.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 11.3 t0 69.22 117.53 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 O-C-N 124.175 0.922 . . . . 0.0 111.185 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.649 HD12 HG13 ' A' ' 117' ' ' VAL . 14.9 mt -75.83 -25.76 56.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.443 -177.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.617 ' HA ' HD13 ' A' ' 60' ' ' LEU . 11.5 t70 -60.73 -41.1 94.65 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.415 ' HB3' ' HZ2' ' A' ' 142' ' ' LYS . 4.1 mm-40 -70.8 -36.38 72.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.672 172.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.457 ' HB2' ' HA ' ' A' ' 136' ' ' LEU . . . -65.37 -53.35 44.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.921 0.391 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.758 HD12 HD11 ' A' ' 60' ' ' LEU . 55.6 mt -60.34 -40.91 85.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.145 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -58.35 -48.75 79.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.415 ' HZ2' ' HB3' ' A' ' 138' ' ' GLU . 18.3 mtmm -66.32 -20.04 65.98 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.961 -179.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.697 HD23 ' HG ' ' A' ' 119' ' ' LEU . 66.7 mt -66.83 -39.85 87.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.413 0.625 . . . . 0.0 109.866 172.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.495 ' HA ' HH12 ' A' ' 122' ' ' ARG . 96.2 mt . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.737 177.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.669 HD13 HD11 ' A' ' 30' ' ' LEU . 15.3 tt . . . . . 0 N--CA 1.446 -0.653 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.554 ' O ' HD13 ' A' ' 30' ' ' LEU . 4.0 mp -87.65 112.66 23.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.3 108.56 4.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.175 0.512 . . . . 0.0 109.868 -177.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.5 mt -101.43 114.93 42.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.043 -178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.545 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 79.2 mt-30 -105.58 101.11 10.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.869 -178.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.5 mt -132.22 158.28 42.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.193 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 26' ' ' ASN . 54.1 mttm -88.73 145.59 25.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.884 0.373 . . . . 0.0 111.536 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.552 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 25.9 m-20 -69.06 -177.0 0.96 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.263 174.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.662 HD12 ' HZ2' ' A' ' 84' ' ' LYS . 3.5 pp -61.7 -28.48 69.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.972 0.891 . . . . 0.0 109.14 168.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.841 ' HZ2' ' HB3' ' A' ' 24' ' ' LYS . 9.2 mtpm? -79.0 -7.18 57.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.024 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.434 ' HA2' ' HB3' ' A' ' 21' ' ' LYS . . . 81.93 16.04 73.53 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.947 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.552 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 11.6 m-20 -80.91 108.45 14.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.434 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.2 m -68.48 107.56 2.95 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.613 175.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -100.76 131.21 46.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.145 -178.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.545 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 24.5 p -102.36 161.66 13.53 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 170.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.669 HD11 HD13 ' A' ' 15' ' ' ILE . 51.1 mt -80.29 -29.02 38.17 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.556 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 p -67.5 -8.34 32.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.392 175.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -90.29 -45.14 9.24 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.453 ' CD1' ' HG2' ' A' ' 70' ' ' GLU . 1.4 mm? -67.5 -11.87 58.98 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 113.89 -1.505 . . . . 0.0 111.364 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 124' ' ' ASN . 8.7 ttpp -57.26 101.74 0.07 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.024 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 162.81 -39.95 0.35 Allowed Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.806 -1.317 . . . . 0.0 109.806 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.673 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 98.9 mttt -100.95 174.01 6.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 171.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.572 HG11 ' HD1' ' A' ' 69' ' ' PHE . 3.4 p -83.43 118.64 31.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 167.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.22 124.58 55.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.289 -167.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.472 HD13 ' CD2' ' A' ' 136' ' ' LEU . 12.2 tp -93.04 107.58 19.34 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.205 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.575 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.8 mm -84.73 106.54 14.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.553 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 28.8 t0 -101.62 129.8 47.82 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.883 -177.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -120.97 97.93 5.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.022 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.409 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -148.95 164.8 33.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.013 0.435 . . . . 0.0 111.573 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.404 HG12 ' O ' ' A' ' 76' ' ' LEU . 5.1 m -97.3 144.77 10.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.872 178.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.605 ' H ' ' HB3' ' A' ' 77' ' ' ASP . 7.3 m-85 -105.98 78.44 1.32 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.602 0.715 . . . . 0.0 110.436 172.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -163.15 16.82 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -144.48 131.88 20.85 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.171 -158.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.02 72.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.061 -175.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.14 -24.76 68.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 0.0 110.973 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.3 m -74.76 -27.3 60.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.094 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.52 -38.3 68.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.153 0.501 . . . . 0.0 110.231 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.07 -25.89 61.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.527 0.679 . . . . 0.0 109.802 174.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.522 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.7 t60 -75.32 -47.55 27.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.197 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.648 ' HA ' HD13 ' A' ' 57' ' ' LEU . 33.7 p30 -73.76 -21.28 60.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.86 0.362 . . . . 0.0 110.889 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.31 -57.49 12.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.804 172.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.07 75.13 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.664 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.648 HD13 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -63.21 -41.25 99.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.935 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -63.25 -31.43 72.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.329 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -74.48 -55.11 6.32 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 122.789 1.281 . . . . 0.0 108.041 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.704 HD11 HD13 ' A' ' 140' ' ' ILE . 2.0 mm? -55.0 -30.89 60.46 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.565 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -76.93 -46.25 24.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -62.61 -22.13 66.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.802 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -77.98 -61.61 1.94 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.194 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.568 ' OH ' ' HE3' ' A' ' 141' ' ' LYS . 96.3 m-85 -108.57 -1.43 19.65 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -164.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.444 ' C ' ' H ' ' A' ' 67' ' ' GLN . . . -68.01 170.22 8.7 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.438 176.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.2 m 71.5 -38.43 0.42 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.119 0.567 . . . . 0.0 111.08 -174.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 65' ' ' ALA . 61.1 mt-30 -71.01 -9.81 58.66 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.457 0.646 . . . . 0.0 110.514 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.421 ' O ' HG13 ' A' ' 37' ' ' VAL . . . 117.7 34.36 1.18 Allowed Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.201 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.572 ' HD1' HG11 ' A' ' 37' ' ' VAL . 82.0 t80 -112.36 142.11 45.28 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 177.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.673 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.2 tp10 -143.17 155.34 44.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 178.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.5 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 54.7 mt -123.11 126.16 73.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.176 0.513 . . . . 0.0 109.993 175.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.536 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 78.6 t80 -112.08 100.87 9.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.553 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 31.2 tt0 -98.28 129.21 44.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.679 -175.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 57.2 mt -109.31 120.1 59.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.847 175.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 89.7 p -89.48 125.81 35.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.48 0.657 . . . . 0.0 110.336 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.404 ' O ' HG12 ' A' ' 44' ' ' VAL . 14.3 mt -102.46 32.81 3.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 175.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.605 ' HB3' ' H ' ' A' ' 45' ' ' TYR . 4.6 p-10 -73.03 177.98 4.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.393 -168.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.89 26.03 4.57 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.011 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -162.89 109.36 1.19 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.467 ' HB2' HH12 ' A' ' 96' ' ' ARG . 35.1 tt0 -58.84 -40.97 85.8 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.706 -176.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -48.6 80.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.628 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -63.28 -47.85 80.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.859 0.362 . . . . 0.0 110.251 -175.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 21.5 t90 -61.1 -52.28 65.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.462 175.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.662 ' HZ2' HD12 ' A' ' 23' ' ' LEU . 26.3 tptp -52.57 -60.26 3.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.188 -177.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.8 m -60.06 -31.53 70.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.98 -173.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.0 t -85.32 -30.71 23.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 0.0 111.533 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.548 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.9 -18.76 26.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.328 0.585 . . . . 0.0 110.617 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.402 ' OD2' ' HG3' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -65.23 -8.14 16.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.414 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -116.37 16.34 15.72 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.497 0.665 . . . . 0.0 110.206 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.548 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 37.1 mt -87.04 141.28 33.02 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 121.495 0.664 . . . . 0.0 111.575 -178.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.674 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 68.7 Cg_endo -80.22 -30.13 2.23 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 123.919 3.079 . . . . 0.0 112.956 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.674 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.2 p90 -102.16 -169.28 1.65 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.258 -172.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.536 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 44.9 t -77.79 133.17 31.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.882 -176.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.515 ' SG ' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -140.63 95.48 2.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.431 0.634 . . . . 0.0 110.399 -176.12 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.462 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 18.0 m -113.79 170.27 4.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.158 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.467 HH12 ' HB2' ' A' ' 80' ' ' GLU . 38.0 ttp180 -126.19 138.31 53.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.599 0.238 . . . . 0.0 111.039 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -81.1 157.59 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.027 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.56 -23.3 37.27 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -175.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.59 -11.71 8.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.646 0.26 . . . . 0.0 111.642 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 71.23 -121.1 8.85 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.606 -0.806 . . . . 0.0 111.853 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.26 -14.93 62.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.984 0.421 . . . . 0.0 110.928 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -95.88 12.25 30.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.566 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.493 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.2 t -65.97 141.59 58.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.78 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.8 m -69.82 -24.03 63.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.202 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -59.56 -47.66 84.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 178.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.493 HG13 ' HB3' ' A' ' 103' ' ' SER . 32.5 mt -57.99 -36.67 57.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.281 -176.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.8 m -68.93 -27.22 65.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.283 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.5 -27.15 64.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.753 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -87.17 1.53 52.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.64 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.975 0 C-N-CA 123.74 0.816 . . . . 0.0 111.182 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.487 ' CD2' ' HB2' ' A' ' 116' ' ' SER . 27.7 mt . . . . . 0 C--O 1.233 0.21 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.476 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 63.1 Cg_endo -71.7 156.09 97.46 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.853 -1.311 . . . . 0.0 113.017 0.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.487 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 5.9 m -146.16 173.74 11.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.263 -177.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.423 HG13 HD21 ' A' ' 136' ' ' LEU . 2.4 p -129.59 161.33 39.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.034 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.575 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.5 m-85 -137.6 157.78 45.78 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 174.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.87 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 6.8 tp -110.96 139.35 46.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -175.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.486 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.0 t -135.62 121.02 29.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.552 0.215 . . . . 0.0 110.964 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -76.39 164.15 26.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.466 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 34.1 mtt180 -52.3 -18.59 1.64 Allowed 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.155 0.91 . . . . 0.0 113.319 -169.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -84.74 6.25 25.08 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.519 ' HB2' ' HB2' ' A' ' 34' ' ' LYS . 1.6 t-20 63.0 52.23 2.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.538 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.486 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 49.5 mt-10 -127.22 143.57 51.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.422 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.0 tt -68.85 109.81 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.306 0.574 . . . . 0.0 110.176 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.87 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 58.1 m -76.82 -53.96 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.291 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -162.54 153.83 17.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 -177.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.588 ' O ' HG13 ' A' ' 133' ' ' ILE . 91.7 mtt180 -89.28 156.81 18.5 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.328 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.16 -26.14 60.9 Favored Glycine 0 C--O 1.225 -0.463 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -71.64 -11.78 61.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.443 0.639 . . . . 0.0 110.393 177.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -115.67 -37.22 4.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.069 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.753 HG22 ' HG ' ' A' ' 136' ' ' LEU . 42.7 mt -68.65 145.97 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -128.94 -43.02 1.36 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -130.78 111.92 12.58 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.552 173.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.753 ' HG ' HG22 ' A' ' 133' ' ' ILE . 5.8 mp -77.67 -30.48 52.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.963 -178.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -48.38 -57.83 5.49 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.609 0.568 . . . . 0.0 110.529 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.625 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 37.5 mm-40 -58.84 -43.02 90.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.935 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.423 ' HB3' HD22 ' A' ' 119' ' ' LEU . . . -60.76 -43.14 98.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.341 -175.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.704 HD13 HD11 ' A' ' 60' ' ' LEU . 40.7 mt -57.89 -44.43 86.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.717 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.579 ' HB2' ' O ' ' A' ' 138' ' ' GLU . 22.7 mttt -51.1 -55.42 17.78 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.447 0.642 . . . . 0.0 111.234 176.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.625 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 2.6 ptpt -74.2 -18.07 60.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.228 -0.897 . . . . 0.0 112.353 -173.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -83.71 -40.06 19.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.64 0.257 . . . . 0.0 111.245 173.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 71.8 mt . . . . . 0 CA--C 1.52 -0.202 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.8 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.638 HG23 ' O ' ' A' ' 124' ' ' ASN . 7.7 pt . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.465 ' O ' HD11 ' A' ' 30' ' ' LEU . 89.0 mt -108.55 113.86 45.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 173.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -98.5 108.55 21.27 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 mt -94.4 121.43 45.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.714 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.56 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 32.3 mt-30 -119.04 100.77 7.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.49 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.1 mt -135.3 154.46 51.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 93.0 mttt -79.16 141.62 37.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.159 0.504 . . . . 0.0 110.894 -176.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.591 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 4.0 p-10 -88.45 -169.02 2.39 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.902 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.454 HD12 ' HB1' ' A' ' 87' ' ' ALA . 49.3 tp -52.99 -37.83 61.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.702 177.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -71.2 -27.79 63.75 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -177.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.26 18.52 14.61 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.504 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -108.27 127.9 54.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.599 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.7 m -63.12 110.6 1.89 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.383 0.611 . . . . 0.0 110.856 178.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.56 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 21.3 mmm180 -86.15 134.85 33.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.967 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.1 p -118.5 155.91 30.0 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 173.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.58 HD23 HG13 ' A' ' 38' ' ' VAL . 71.9 mt -73.29 -23.14 60.26 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 p -71.82 -0.92 12.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.72 175.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -98.11 -47.11 5.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.954 0.407 . . . . 0.0 110.882 178.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.706 ' HG ' HG21 ' A' ' 38' ' ' VAL . 0.6 OUTLIER -91.9 24.72 3.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.71 0.767 . . . . 0.0 109.41 175.334 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.596 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 59.4 tttp -55.92 -42.95 76.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.983 -1.462 . . . . 0.0 112.524 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.16 3.45 38.49 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 115.786 -0.643 . . . . 0.0 113.478 -176.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 6.6 mppt? -125.47 168.81 13.1 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.733 HG23 HD23 ' A' ' 144' ' ' LEU . 45.5 t -73.19 124.91 31.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.706 HG21 ' HG ' ' A' ' 33' ' ' LEU . 46.7 t -109.01 124.39 65.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.387 0.613 . . . . 0.0 111.462 -169.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.45 HD21 ' HZ ' ' A' ' 69' ' ' PHE . 12.2 tp -97.35 133.61 41.72 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 171.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.58 HG13 ' HB2' ' A' ' 118' ' ' PHE . 1.1 pt -118.1 106.9 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.185 0.517 . . . . 0.0 110.873 175.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.459 ' HB2' ' HA ' ' A' ' 73' ' ' GLN . 13.8 m-20 -98.22 133.28 42.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.858 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -117.33 97.32 5.84 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.439 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 11.1 t -143.7 179.27 7.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 -175.023 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.642 HG11 ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -126.02 124.29 65.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 120.725 0.298 . . . . 0.0 110.325 -178.879 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.689 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 28.8 m-85 -74.98 79.43 2.18 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.235 0.54 . . . . 0.0 110.006 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 41.3 t30 172.95 -32.33 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.366 -1.288 . . . . 0.0 108.661 174.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.642 ' HB2' HG11 ' A' ' 44' ' ' VAL . 37.4 t-20 -65.1 133.89 52.6 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.852 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -30.8 69.28 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.529 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 90.0 mtp -67.94 -22.54 65.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.347 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -71.14 -23.33 62.05 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.288 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.81 18.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.848 0.356 . . . . 0.0 110.718 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.04 -39.31 93.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.69 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.473 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.3 t60 -62.85 -45.12 94.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.991 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.649 ' HA ' HD11 ' A' ' 57' ' ' LEU . 5.3 m-20 -74.7 -22.17 58.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.782 -176.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.459 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -68.58 -43.57 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.36 -38.88 81.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.737 174.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.649 HD11 ' HA ' ' A' ' 54' ' ' ASN . 86.7 mt -62.51 -42.29 99.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.001 177.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.4 tpm_? -54.84 -36.03 64.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.777 176.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -79.97 -50.29 10.63 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -173.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.844 HD12 HD12 ' A' ' 140' ' ' ILE . 2.7 mm? -55.77 -30.72 61.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 113.271 -1.786 . . . . 0.0 111.429 178.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -72.72 -48.38 39.24 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.231 0.539 . . . . 0.0 109.685 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -63.38 -21.18 66.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.643 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.542 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 33.5 mttm -82.21 -61.32 1.93 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.925 -178.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.486 ' HB3' HD11 ' A' ' 144' ' ' LEU . 83.8 m-85 -113.35 -5.85 13.55 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -164.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.571 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.15 -34.9 75.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.248 0.476 . . . . 0.0 111.585 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 m -63.17 -22.07 66.62 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.775 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -98.57 18.59 16.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.701 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.04 54.43 1.62 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.344 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.571 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 54.0 t80 -132.29 125.9 32.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.71 0.29 . . . . 0.0 110.274 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.454 ' HB3' HD13 ' A' ' 33' ' ' LEU . 28.9 tt0 -125.36 154.73 41.4 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.573 ' HB ' ' CB ' ' A' ' 92' ' ' TRP . 49.8 mt -118.8 126.32 75.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.06 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.46 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 75.7 t80 -112.78 100.12 8.43 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.275 -0.875 . . . . 0.0 108.859 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.459 ' HA ' ' HB2' ' A' ' 41' ' ' ASP . 6.1 tt0 -102.48 126.32 49.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.348 -175.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 54.9 mt -103.56 129.09 56.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.339 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.689 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 3.8 p -95.85 131.63 41.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.449 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 22.2 mt -116.45 33.67 5.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.24 0.543 . . . . 0.0 109.741 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.489 ' OD2' ' HB2' ' A' ' 75' ' ' SER . 3.5 p30 -85.29 -165.91 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.752 -175.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -135.5 30.16 2.81 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.779 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -151.36 101.93 2.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.993 0.425 . . . . 0.0 110.632 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -64.98 -31.76 73.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.653 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -46.0 90.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.564 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -71.97 -42.02 67.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.834 0.349 . . . . 0.0 110.6 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 36.9 t90 -60.77 -48.38 82.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.747 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.463 ' HB2' ' HE3' ' A' ' 84' ' ' LYS . 37.2 ttmt -62.18 -42.14 98.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.806 -175.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 7.9 p -71.22 -40.15 71.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.831 0.348 . . . . 0.0 111.264 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.519 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 25.3 t -69.9 -45.62 67.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.713 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.454 ' HB1' HD12 ' A' ' 23' ' ' LEU . . . -66.95 -26.32 66.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.622 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.85 -31.34 71.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.763 0.315 . . . . 0.0 111.071 -178.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -102.64 7.86 39.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.935 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 86' ' ' SER . 40.0 mt -94.74 140.62 22.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.233 0.54 . . . . 0.0 111.339 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.582 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.2 Cg_endo -72.45 -49.3 0.28 Allowed 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 123.875 3.05 . . . . 0.0 113.938 -174.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.582 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.1 p90 -81.88 -172.31 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.984 0.421 . . . . 0.0 111.933 -173.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.441 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 90.6 t -85.8 117.52 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.357 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 34.1 m -113.68 108.8 17.61 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.911 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.591 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 23.2 m -114.77 172.1 4.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.934 -179.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -133.04 140.37 47.68 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.085 -177.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -93.03 151.0 20.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.06 -18.52 42.84 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -115.82 -12.17 11.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.812 0.339 . . . . 0.0 111.033 -175.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.449 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 66.41 -121.29 17.43 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.074 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.62 -6.81 43.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.765 0.316 . . . . 0.0 111.303 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -100.97 15.8 27.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.428 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.444 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.6 t -63.6 132.68 51.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.172 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.489 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 16.5 m -59.38 -28.95 67.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.172 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -60.79 -45.42 94.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.735 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.444 HG13 ' HB3' ' A' ' 103' ' ' SER . 43.2 mt -58.0 -36.2 55.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.113 0.482 . . . . 0.0 110.433 -177.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -72.67 -39.66 66.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.535 177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.7 mt -64.26 -32.12 73.58 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.573 -178.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -69.99 -27.3 64.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.947 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.451 ' C ' HD21 ' A' ' 110' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 -164.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.564 HD22 ' HA ' ' A' ' 115' ' ' PRO . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.564 ' HA ' HD22 ' A' ' 114' ' ' LEU . 33.6 Cg_endo -63.83 139.97 36.87 Favored 'Cis proline' 0 C--N 1.354 0.858 0 C-N-CA 124.371 -1.096 . . . . 0.0 113.433 1.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.11 177.6 7.33 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.98 -177.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 7.9 p -138.05 159.25 33.09 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.627 ' HE2' ' HD2' ' A' ' 129' ' ' ARG . 86.2 m-85 -138.04 163.27 32.02 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 1.01 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.4 tp -110.98 135.03 52.1 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.745 -174.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.544 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 49.1 t -131.18 117.53 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.32 0.581 . . . . 0.0 110.301 172.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.496 ' HB2' HD22 ' A' ' 143' ' ' LEU . 31.4 t30 -70.84 161.15 31.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.439 ' HB3' HG21 ' A' ' 37' ' ' VAL . 17.0 ptt180 -73.88 29.68 0.08 Allowed 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -170.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . 0.525 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 4.4 t-20 -120.37 2.97 10.83 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 169.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.638 ' O ' HG23 ' A' ' 15' ' ' ILE . 0.2 OUTLIER 69.28 62.78 0.29 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.709 -167.016 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.544 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 38.3 mt-10 -122.2 123.81 42.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.019 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 tt -62.04 106.8 0.76 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 171.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 1.01 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 47.0 m -83.08 -54.7 4.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.972 -172.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -167.66 172.13 9.58 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.755 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.627 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 19.6 mmt85 -78.62 175.39 10.43 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -80.63 -26.62 53.65 Favored Glycine 0 C--N 1.315 -0.585 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.616 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.435 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 mp0 -75.47 -41.85 54.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.164 0.507 . . . . 0.0 112.021 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.578 HD21 ' N ' ' A' ' 133' ' ' ILE . 0.2 OUTLIER -81.03 -6.58 58.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.704 -176.332 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.634 HG23 ' HG ' ' A' ' 136' ' ' LEU . 63.3 mt -85.61 110.26 19.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.313 0.578 . . . . 0.0 109.975 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -61.01 -25.36 66.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.026 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.463 ' OD2' ' HB3' ' A' ' 137' ' ' ASP . 36.2 t70 -173.05 116.48 0.28 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.634 ' HG ' HG23 ' A' ' 133' ' ' ILE . 3.4 mp -75.17 -28.52 60.11 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.924 -0.311 . . . . 0.0 111.043 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.463 ' HB3' ' OD2' ' A' ' 135' ' ' ASP . 9.3 t70 -53.51 -54.93 30.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 173.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.22 -48.55 68.07 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.666 172.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.465 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -64.24 -52.12 60.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.373 -172.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.844 HD12 HD12 ' A' ' 60' ' ' LEU . 37.6 mt -61.3 -36.83 75.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.275 0.56 . . . . 0.0 110.295 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 17.2 ttpt -60.11 -40.0 88.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.149 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 139' ' ' ALA . 17.1 ptpt -85.02 -19.73 31.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.244 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.513 HD13 ' HG ' ' A' ' 119' ' ' LEU . 16.0 mt -75.15 -32.83 61.43 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.682 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.733 HD23 HG23 ' A' ' 37' ' ' VAL . 34.0 mt . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.518 178.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.3 tp . . . . . 0 N--CA 1.448 -0.558 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.45 ' N ' HD13 ' A' ' 16' ' ' ILE . 4.1 mp -98.9 104.56 16.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.11 110.9 2.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.288 0.566 . . . . 0.0 110.093 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.446 HG23 ' CD1' ' A' ' 74' ' ' ILE . 25.1 mm -90.4 108.6 19.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.259 -178.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.616 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 19.4 mt-30 -105.31 99.8 9.4 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.192 0.52 . . . . 0.0 110.795 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.2 mt -138.35 159.0 43.19 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.606 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 46.0 mtmt -89.69 138.18 31.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.737 0.779 . . . . 0.0 111.395 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.628 ' OD1' ' HG ' ' A' ' 23' ' ' LEU . 9.9 t70 -71.09 169.04 15.85 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.819 -1.537 . . . . 0.0 109.821 176.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.829 HD12 ' HA ' ' A' ' 88' ' ' ASP . 2.5 pp -51.82 -34.68 41.34 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.695 0.759 . . . . 0.0 111.212 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -69.34 -6.91 32.76 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.115 177.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.523 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 89.74 7.91 68.18 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.308 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -101.69 118.29 36.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.553 0.216 . . . . 0.0 111.487 -175.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.606 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 24.3 m -58.28 124.01 18.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.223 0.535 . . . . 0.0 110.839 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.616 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.3 mmm180 -107.03 142.98 35.8 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.563 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.5 p -120.17 162.34 19.51 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.651 ' HB3' HD22 ' A' ' 124' ' ' ASN . 49.9 mt -80.1 -29.65 39.07 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.3 p -59.33 -22.89 61.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.701 173.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -85.5 -52.56 5.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.153 176.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -13.98 11.52 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.221 -178.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.664 ' HZ3' ' HB3' ' A' ' 34' ' ' LYS . 3.6 ttpm? -53.48 -14.98 0.91 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.224 1.01 . . . . 0.0 112.475 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.527 ' C ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.1 -16.37 59.8 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.651 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.527 ' HD2' ' C ' ' A' ' 35' ' ' GLY . 2.9 mptp? -136.14 -178.9 5.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 110.397 176.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.718 HG23 HD23 ' A' ' 144' ' ' LEU . 56.3 t -78.58 123.29 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 172.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.1 t -103.32 122.27 55.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.308 0.575 . . . . 0.0 112.204 -163.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.732 HD12 HD21 ' A' ' 136' ' ' LEU . 13.0 tp -92.06 122.13 34.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.739 171.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.511 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.0 mm -98.98 106.03 18.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.695 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 25.6 t70 -108.4 131.07 55.14 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.869 -178.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.495 ' HD2' HD13 ' A' ' 76' ' ' LEU . 32.7 m-85 -119.63 97.77 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.106 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.567 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.2 t -137.39 164.87 27.58 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.996 0.427 . . . . 0.0 111.233 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.53 HG21 ' HB2' ' A' ' 47' ' ' ASN . 3.4 m -102.49 116.75 46.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.051 0.453 . . . . 0.0 110.437 177.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.427 ' HB3' ' HA ' ' A' ' 83' ' ' TRP . 7.4 m-85 -74.89 84.13 2.2 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.699 0.761 . . . . 0.0 109.057 175.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 177.69 -37.81 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.149 -165.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.53 ' HB2' HG21 ' A' ' 44' ' ' VAL . 10.1 t-20 -89.76 146.56 24.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.383 -169.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.31 -30.77 71.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.724 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.3 mmm -64.27 -27.19 68.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.793 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.9 m -69.33 -28.25 66.07 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.164 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.72 -55.7 15.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.866 0.365 . . . . 0.0 110.67 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.03 77.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.623 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.484 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 67.8 t60 -66.13 -38.25 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.454 178.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.431 ' HA ' HD12 ' A' ' 57' ' ' LEU . 23.4 t-20 -66.95 -39.45 87.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.455 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -57.34 -50.23 73.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.501 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.03 83.8 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.005 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.4 mt -62.97 -42.38 99.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 109.943 175.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -61.68 -28.83 69.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.023 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -72.28 -53.25 13.02 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.713 HD11 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -56.56 -32.1 64.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 112.345 -2.207 . . . . 0.0 111.072 176.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -73.1 -47.66 42.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.119 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -61.93 -22.46 65.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.263 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -79.7 -55.83 4.72 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.666 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.563 ' HB3' HD12 ' A' ' 144' ' ' LEU . 93.6 m-85 -118.09 -11.4 10.18 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -165.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.505 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -56.33 -42.87 78.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -174.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.3 p -54.2 -43.48 70.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.414 -176.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -69.69 -33.21 72.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 151.81 47.74 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.303 -0.951 . . . . 0.0 112.582 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.633 ' HZ ' HD23 ' A' ' 39' ' ' LEU . 66.9 t80 -127.92 138.77 52.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.359 -0.238 . . . . 0.0 110.359 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.36 155.56 49.25 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.452 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 46.3 mt -116.84 114.97 47.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.446 0.641 . . . . 0.0 110.503 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.465 ' HH ' HG23 ' A' ' 95' ' ' VAL . 87.7 t80 -100.48 101.3 12.21 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.606 178.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.695 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 10.7 mt-30 -94.86 143.18 26.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.031 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.446 ' CD1' HG23 ' A' ' 18' ' ' ILE . 57.3 mt -127.21 124.88 65.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.715 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.609 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 10.7 p -92.49 129.91 38.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.947 0.403 . . . . 0.0 111.116 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.495 HD13 ' HD2' ' A' ' 42' ' ' PHE . 25.1 mt -112.45 10.5 19.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.88 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.609 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 3.9 p-10 -69.22 -49.99 51.32 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.322 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.94 -34.54 3.24 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.632 176.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -87.04 136.36 32.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.934 0.874 . . . . 0.0 111.367 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 44.1 tt0 -78.7 -29.0 45.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.7 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -79.59 -50.6 10.45 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.286 -167.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -65.44 -39.31 91.9 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.512 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 16.0 t90 -61.99 -47.93 82.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.792 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.685 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 46.2 tttm -68.34 -49.72 58.33 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.968 -176.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.6 p -58.93 -30.31 67.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.202 0.525 . . . . 0.0 111.423 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.1 m -82.84 -46.22 13.32 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.684 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.474 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.24 -18.8 27.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -171.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.829 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.6 t70 -55.36 -33.56 63.52 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.93 0.492 . . . . 0.0 111.981 -170.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -104.26 11.72 34.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.145 -176.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.506 ' HB3' ' HD2' ' A' ' 91' ' ' PRO . 23.3 mt -81.83 157.7 68.86 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 121.121 0.486 . . . . 0.0 111.712 -176.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.591 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 72.1 Cg_endo -69.8 -44.41 2.07 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.744 2.963 . . . . 0.0 114.208 -176.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.591 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -100.75 -170.69 1.89 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 112.005 -171.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.523 HG13 ' HG3' ' A' ' 28' ' ' ARG . 90.3 t -83.79 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.775 -176.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 84.0 m -136.17 108.81 7.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.07 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.465 HG23 ' HH ' ' A' ' 72' ' ' TYR . 14.6 m -113.89 159.8 13.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.009 -177.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 80' ' ' GLU . 12.2 ttp180 -117.73 134.42 54.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.379 -177.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -92.69 143.56 26.18 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.35 -14.09 55.84 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -99.95 -13.31 19.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.744 -172.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.406 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . 64.62 -98.45 0.28 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.747 178.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -105.92 1.49 26.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.956 0.408 . . . . 0.0 110.891 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -104.56 9.47 35.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.119 0.485 . . . . 0.0 110.193 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.527 ' HB2' HG13 ' A' ' 106' ' ' ILE . 4.2 m -65.27 122.21 16.59 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.554 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.53 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.3 m -55.17 -27.1 43.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.867 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -55.59 -47.24 76.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.613 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.527 HG13 ' HB2' ' A' ' 103' ' ' SER . 53.1 mt -57.07 -34.77 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.765 -176.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.9 m -77.17 -37.27 54.11 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 177.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 104' ' ' SER . 96.7 mt -63.58 -37.65 88.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.599 -178.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -71.53 -24.41 61.94 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.412 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 . . . . . 0 C--N 1.331 -0.202 0 CA-C-O 122.1 0.953 . . . . 0.0 108.758 -165.398 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.46 HD13 ' OG ' ' A' ' 116' ' ' SER . 3.7 mm? . . . . . 0 N--CA 1.465 0.28 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.97 143.02 74.8 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 123.86 -1.308 . . . . 0.0 112.919 0.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.46 ' OG ' HD13 ' A' ' 114' ' ' LEU . 13.3 m -121.04 169.99 9.96 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.464 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.8 p -142.25 156.71 19.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.511 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.7 m-85 -140.23 160.16 40.57 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.865 HD12 HD13 ' A' ' 136' ' ' LEU . 13.9 tp -111.0 134.93 52.21 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -174.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.6 t -135.51 120.44 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.775 0.321 . . . . 0.0 110.554 177.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.639 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.1 p30 -77.74 167.56 21.36 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 4.68 0.78 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -168.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -95.65 5.3 51.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.651 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.7 t-20 64.42 48.05 2.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.277 -172.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.639 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 42.4 mt-10 -119.12 136.85 53.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.615 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.86 118.05 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.324 0.583 . . . . 0.0 110.801 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.608 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 18.4 m -87.31 -53.45 4.83 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.877 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.09 169.14 14.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.172 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.472 ' O ' HG13 ' A' ' 133' ' ' ILE . 93.4 mtt180 -91.7 168.33 11.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.885 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -65.16 -36.55 93.03 Favored Glycine 0 CA--C 1.509 -0.316 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.442 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 pm0 -75.93 -0.14 20.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.086 0.469 . . . . 0.0 111.125 177.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -110.07 -19.47 13.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.167 0.508 . . . . 0.0 110.05 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.512 HD11 ' HB2' ' A' ' 119' ' ' LEU . 97.2 mt -82.9 108.3 15.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.73 -177.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.712 ' H ' ' HD2' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -82.99 -26.34 31.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.955 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -161.36 110.43 1.58 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.865 HD13 HD12 ' A' ' 119' ' ' LEU . 2.8 tp -76.78 -33.17 58.05 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.754 -175.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.442 ' HA ' HD13 ' A' ' 60' ' ' LEU . 10.1 t70 -51.54 -52.83 43.81 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.48 177.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.536 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 28.7 mm-40 -56.57 -52.22 65.64 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.64 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.456 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.97 -50.6 71.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.183 -172.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.72 HD11 ' HG ' ' A' ' 136' ' ' LEU . 52.2 mt -59.55 -40.54 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.213 0.53 . . . . 0.0 110.249 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.416 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 29.4 ttpt -56.78 -47.59 79.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.016 178.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.536 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 11.5 ptpt -81.54 -18.88 43.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.76 -176.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 40.2 mt -71.91 -39.59 69.42 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 110.401 173.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.718 HD23 HG23 ' A' ' 37' ' ' VAL . 66.6 mt . . . . . 0 N--CA 1.453 -0.306 0 CA-C-O 121.504 0.669 . . . . 0.0 109.938 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.4 tp . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 120.982 0.42 . . . . 0.0 110.718 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.521 ' O ' HD11 ' A' ' 30' ' ' LEU . 4.2 mp -101.69 126.23 55.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -80.03 108.02 13.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.482 HD11 ' OH ' ' A' ' 109' ' ' TYR . 11.1 mt -96.07 125.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.729 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.599 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 28.9 mt-30 -118.73 99.96 7.11 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.985 0.421 . . . . 0.0 110.365 -178.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.7 mt -133.63 156.46 47.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 95.4 mttt -87.64 139.63 30.34 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.053 0.454 . . . . 0.0 111.308 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 7.8 p30 -87.82 -167.22 1.81 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.892 -176.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.576 HD12 ' HB3' ' A' ' 87' ' ' ALA . 55.3 tp -50.02 -36.15 27.63 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.272 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.735 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 8.9 mtmp? -84.87 -5.53 59.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.497 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.88 17.48 63.27 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -176.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.47 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.9 OUTLIER -97.08 117.26 30.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.209 -0.496 . . . . 0.0 110.275 -177.717 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.582 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 54.7 m -61.74 118.94 7.8 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.153 0.501 . . . . 0.0 111.269 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.599 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.9 mmm180 -101.38 139.17 37.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.498 176.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 36.8 p -118.06 161.89 19.09 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 172.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.521 HD11 ' O ' ' A' ' 16' ' ' ILE . 58.0 mt -79.88 -21.29 44.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.642 0.734 . . . . 0.0 109.863 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.35 -8.21 52.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.625 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -89.94 -60.51 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.994 0.426 . . . . 0.0 110.512 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.4 ' CD2' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -77.96 9.18 3.81 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 121.782 0.801 . . . . 0.0 111.066 -177.265 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.601 ' HZ3' ' HB3' ' A' ' 124' ' ' ASN . 24.1 ttmm -54.75 141.45 32.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.477 171.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.64 -25.53 8.5 Favored Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 -173.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.736 ' HB2' ' HZ2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -120.96 170.62 9.33 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.287 173.346 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.633 HG11 ' HG2' ' A' ' 122' ' ' ARG . 1.6 m -79.95 134.71 26.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.466 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 41.3 t -117.02 130.98 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-O 121.184 0.516 . . . . 0.0 111.155 -170.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.515 ' HB3' HG23 ' A' ' 71' ' ' ILE . 11.8 tp -94.96 107.52 19.56 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.649 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.652 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.8 mm -85.6 105.49 14.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.43 ' CG ' ' HE2' ' A' ' 53' ' ' HIS . 1.8 t70 -107.18 131.6 53.97 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.287 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -116.03 97.32 6.01 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.719 ' O ' ' HA ' ' A' ' 75' ' ' SER . 22.7 m -144.63 147.32 32.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.182 0.515 . . . . 0.0 111.161 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.51 HG23 ' HB3' ' A' ' 77' ' ' ASP . 1.6 p -95.46 123.01 47.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 122.236 -0.29 . . . . 0.0 110.946 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.682 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 30.5 m-85 -82.69 79.07 9.2 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.01 0.91 . . . . 0.0 109.659 175.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.404 ' HB3' HG22 ' A' ' 44' ' ' VAL . 7.3 t-20 -178.13 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 113.569 -1.65 . . . . 0.0 109.078 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.505 ' HB2' ' CG1' ' A' ' 44' ' ' VAL . 30.0 t-20 -71.85 142.86 49.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.558 -178.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.07 -30.12 69.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.822 -175.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 21.8 ptp -71.45 -17.06 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.0 0.429 . . . . 0.0 111.088 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.2 m -71.17 -30.58 66.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.517 -177.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.61 -47.31 86.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.878 0.371 . . . . 0.0 111.137 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.133 0.492 . . . . 0.0 110.646 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.474 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.5 t60 -68.12 -40.89 82.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.625 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.521 ' HA ' HD12 ' A' ' 57' ' ' LEU . 92.5 m-20 -63.65 -34.01 76.91 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.792 0.33 . . . . 0.0 111.05 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.11 -53.75 54.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.415 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.54 -35.59 76.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.06 -178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 54' ' ' ASN . 86.8 mt -64.17 -41.55 97.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.515 0.674 . . . . 0.0 109.69 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 58' ' ' ARG . 28.5 tpt85 -64.56 -27.34 68.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.094 -178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.484 ' OE2' ' HE3' ' A' ' 63' ' ' LYS . 3.7 tm-20 -75.54 -56.16 4.97 Favored 'General case' 0 CA--C 1.489 -1.385 0 CA-C-O 123.003 1.382 . . . . 0.0 107.801 -174.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.529 HD11 HD13 ' A' ' 140' ' ' ILE . 3.0 mm? -55.02 -29.33 57.15 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 111.819 -2.446 . . . . 0.0 111.067 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.402 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 35.5 t80 -66.86 -49.17 66.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.24 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.34 -26.38 66.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.713 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.484 ' HE3' ' OE2' ' A' ' 59' ' ' GLU . 74.2 mttt -77.02 -61.48 1.97 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.685 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -109.54 -11.84 14.75 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -164.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.568 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.53 -37.9 82.69 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.189 0.45 . . . . 0.0 111.494 -177.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.4 m -65.11 -13.87 59.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.839 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -101.39 6.64 42.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.087 0.47 . . . . 0.0 110.955 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.51 54.24 0.89 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.175 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.612 ' HD1' HG22 ' A' ' 37' ' ' VAL . 37.2 t80 -130.57 131.66 45.13 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 178.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -130.69 156.15 45.4 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.589 HD12 ' CE3' ' A' ' 92' ' ' TRP . 43.6 mt -122.34 129.13 75.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-O 120.995 0.426 . . . . 0.0 110.152 -175.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.449 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 89.8 t80 -113.27 100.4 8.54 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.237 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.79 140.99 29.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.819 -177.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.466 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 59.9 mt -127.16 107.8 17.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.606 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.719 ' HA ' ' O ' ' A' ' 43' ' ' THR . 0.0 OUTLIER -77.77 129.44 35.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.998 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.41 ' H ' ' HA ' ' A' ' 44' ' ' VAL . 48.2 mt -110.34 38.75 2.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.51 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.1 p30 -100.72 -178.77 3.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.449 -175.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 -25.64 4.8 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.481 173.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.601 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 30.4 t70 -103.14 97.47 7.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.997 0.427 . . . . 0.0 110.689 -177.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.647 ' HB3' ' CZ ' ' A' ' 96' ' ' ARG . 10.0 pt-20 -74.79 -13.99 60.65 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.622 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . 0.601 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.2 OUTLIER -52.07 -50.59 61.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.403 173.367 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -70.81 -39.68 72.94 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.165 0.507 . . . . 0.0 110.553 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.601 ' HE3' ' HB2' ' A' ' 80' ' ' GLU . 31.4 t90 -60.27 -46.58 89.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.077 176.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -64.43 -43.73 93.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.281 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.7 p -69.45 -39.06 77.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.5 t -72.87 -37.41 67.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.599 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.618 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -70.17 -23.09 62.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.091 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.03 -27.08 68.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.708 0.766 . . . . 0.0 110.329 174.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -102.46 12.52 36.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.995 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.491 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 24.8 mt -97.98 147.35 32.95 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 121.408 0.623 . . . . 0.0 112.215 -177.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.743 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 14.8 Cg_endo -100.21 3.33 0.8 Allowed 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 124.495 3.463 . . . . 0.0 114.168 -176.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.743 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 2.4 p90 -136.72 -170.09 2.61 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.219 -0.301 . . . . 0.0 111.047 -174.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.48 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 78.7 t -80.89 127.02 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.945 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.618 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 1.6 p -129.63 103.38 6.82 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.209 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.549 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 6.4 m -114.73 156.24 15.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.647 ' CZ ' ' HB3' ' A' ' 80' ' ' GLU . 12.6 ttp180 -120.91 139.06 53.75 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.347 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -89.24 148.54 23.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.59 -16.4 51.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 0.0 111.697 -176.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -107.34 -12.15 15.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.17 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 62.31 -120.69 22.86 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.014 -177.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.48 -5.73 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.356 . . . . 0.0 111.476 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -99.6 12.87 35.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.525 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.424 ' HB3' HG13 ' A' ' 106' ' ' ILE . 42.9 t -64.9 133.53 52.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.798 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.2 m -63.31 -25.1 68.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.796 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -60.63 -44.15 96.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.353 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.424 HG13 ' HB3' ' A' ' 103' ' ' SER . 65.3 mt -56.73 -41.3 74.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.989 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.5 m -66.12 -27.81 68.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.965 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -73.9 -18.27 60.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.04 -179.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.482 ' OH ' HD11 ' A' ' 18' ' ' ILE . 87.8 m-85 -98.27 0.73 46.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.45 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.769 0 O-C-N 123.972 0.795 . . . . 0.0 110.501 -177.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.5 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 46.8 mt . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.5 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 17.3 Cg_exo -67.61 152.59 85.96 Favored 'Cis proline' 0 C--N 1.354 0.847 0 C-N-CA 123.442 -1.483 . . . . 0.0 111.934 0.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 68.7 m -151.21 175.84 11.78 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.034 0.445 . . . . 0.0 111.149 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.515 HG11 HD22 ' A' ' 136' ' ' LEU . 4.4 p -132.66 161.11 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.095 179.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.652 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.2 m-85 -137.42 162.02 34.76 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.907 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 11.9 tp -109.61 135.84 49.93 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.725 -176.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.536 ' CG1' ' HA ' ' A' ' 124' ' ' ASN . 4.0 t -129.84 125.63 61.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.227 0.537 . . . . 0.0 110.654 174.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.511 ' HA ' HG13 ' A' ' 37' ' ' VAL . 28.7 t30 -80.77 167.97 19.34 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.402 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.633 ' HG2' HG11 ' A' ' 37' ' ' VAL . 16.4 mtp180 -56.48 -25.15 50.23 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -165.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . 0.702 ' HB2' ' CD ' ' A' ' 125' ' ' GLU . 90.4 m-20 -90.01 13.16 15.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -177.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.601 ' HB3' ' HZ3' ' A' ' 34' ' ' LYS . 2.8 t-20 60.48 57.55 2.77 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.407 -172.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.702 ' CD ' ' HB2' ' A' ' 123' ' ' ASN . 2.2 mp0 -109.33 134.91 51.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.178 175.028 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.42 107.08 2.31 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.907 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -78.78 -50.78 10.75 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.36 -173.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.09 167.31 10.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.5 -178.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.599 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -94.58 154.58 17.3 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.547 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -51.5 -41.33 48.8 Favored Glycine 0 C--N 1.33 0.231 0 O-C-N 123.434 0.458 . . . . 0.0 113.871 -175.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.445 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.6 OUTLIER -71.36 -18.09 62.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.897 0.38 . . . . 0.0 110.655 -178.016 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.508 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.8 OUTLIER -101.43 -15.14 17.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.719 -176.667 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.843 HG21 ' HG ' ' A' ' 136' ' ' LEU . 90.0 mt -77.08 99.84 2.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.163 0.506 . . . . 0.0 110.387 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.5 ptmt -74.31 87.77 2.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.202 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.41 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 33.8 t70 69.54 116.3 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.376 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.843 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.1 mp -76.13 -33.57 59.42 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.123 -177.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.501 ' HA ' HD13 ' A' ' 60' ' ' LEU . 10.3 t70 -54.15 -59.72 4.28 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.589 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 0.7 OUTLIER -51.89 -46.43 64.52 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.404 173.268 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.603 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.48 -51.71 68.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.033 0.382 . . . . 0.0 112.033 -174.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.623 HG13 ' O ' ' A' ' 136' ' ' LEU . 47.7 mt -57.64 -43.43 83.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.155 0.502 . . . . 0.0 110.081 177.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -59.66 -50.83 72.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.951 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.603 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 24.9 pttt -73.35 -17.13 61.32 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 42.9 mt -70.62 -40.72 72.99 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 169.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.076 175.353 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.449 -0.478 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.423 HD11 ' N ' ' A' ' 16' ' ' ILE . 4.3 mp -89.19 114.49 27.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.01 121.83 18.18 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.469 HD12 ' OH ' ' A' ' 109' ' ' TYR . 9.4 mt -105.07 106.83 21.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.675 -174.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.417 ' CG ' ' HB3' ' A' ' 29' ' ' SER . 19.2 mt-30 -102.05 100.43 10.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.024 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 97' ' ' ASP . 43.9 mt -138.38 156.7 47.35 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.3 mtmt -99.98 153.84 18.87 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 120.58 -0.448 . . . . 0.0 111.584 -172.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.76 -166.4 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.884 -174.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.52 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 6.3 mp -53.61 -46.77 70.54 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.729 177.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -68.32 -44.76 74.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.974 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.482 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 124.7 19.53 2.49 Favored Glycine 0 N--CA 1.44 -1.084 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.79 -176.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.467 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.9 OUTLIER -92.32 119.73 32.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.458 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 45.5 m -64.93 127.83 33.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.99 0.424 . . . . 0.0 111.31 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.468 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.2 mmm180 -108.84 136.32 48.59 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.417 ' HB3' ' CG ' ' A' ' 19' ' ' GLN . 57.3 p -119.0 165.46 14.08 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.578 ' HB3' HD22 ' A' ' 124' ' ' ASN . 64.7 mt -80.99 -28.59 35.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.084 0.469 . . . . 0.0 109.806 177.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 p -63.87 -20.84 66.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.086 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -81.38 -44.3 17.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 122.016 0.913 . . . . 0.0 108.572 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.487 HD21 HG11 ' A' ' 38' ' ' VAL . 2.7 tp -80.26 15.86 1.45 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.798 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.543 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 47.3 tttp -69.41 -14.29 62.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.905 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.14 10.73 65.01 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.324 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.603 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 3.4 mttm -144.97 177.9 8.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.08 0.467 . . . . 0.0 110.389 177.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.63 HG21 ' HD1' ' A' ' 69' ' ' PHE . 14.7 m -92.07 125.84 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.512 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 38.7 t -107.23 135.71 44.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 112.257 -165.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.582 HD11 HG22 ' A' ' 117' ' ' VAL . 2.0 tm? -96.38 120.22 36.3 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.478 -0.783 . . . . 0.0 108.961 170.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.582 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.1 mm -93.95 105.09 16.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 175.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.553 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 31.0 t0 -108.69 135.4 49.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 0.0 111.003 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.715 ' HB3' HD22 ' A' ' 114' ' ' LEU . 70.3 m-85 -123.4 115.44 21.62 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.288 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.421 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.1 t -155.95 174.13 15.78 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.736 0.303 . . . . 0.0 110.692 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.559 ' HB ' ' OD2' ' A' ' 77' ' ' ASP . 2.0 m -116.44 144.83 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.361 176.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.614 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 15.1 m-85 -102.24 81.03 2.03 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.6 . . . . 0.0 110.72 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.72 HD22 ' HB3' ' A' ' 79' ' ' ASP . 8.1 m-20 177.9 21.68 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.502 -1.681 . . . . 0.0 107.895 178.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -141.34 129.47 22.12 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.592 -163.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.85 78.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.039 -173.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -64.28 -21.24 66.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.011 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -74.64 -27.68 60.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.331 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.57 -51.46 35.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 110.894 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.36 -34.01 77.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.252 0.548 . . . . 0.0 110.44 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 68.3 t60 -67.45 -35.86 80.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.271 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -66.95 -37.3 84.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.608 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.6 tt -64.81 -42.04 95.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.361 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.48 85.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.301 0.572 . . . . 0.0 110.333 177.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -66.37 -41.33 89.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.69 176.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.428 ' HA ' ' HZ3' ' A' ' 92' ' ' TRP . 17.0 tpt180 -58.67 -31.94 68.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.102 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.83 -55.88 6.76 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.813 1.292 . . . . 0.0 107.728 -173.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.772 HD12 HD11 ' A' ' 140' ' ' ILE . 2.0 mm? -54.51 -31.74 56.67 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 112.124 -2.307 . . . . 0.0 111.388 177.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -76.72 -43.39 37.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.037 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -61.63 -22.05 64.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.323 0.582 . . . . 0.0 110.591 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -85.38 -61.62 1.72 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.546 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.548 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 95.7 m-85 -108.23 -8.79 15.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -165.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.476 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -65.97 -30.41 70.96 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 121.984 -0.447 . . . . 0.0 111.594 -176.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.8 m -68.24 -18.37 64.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.966 0.413 . . . . 0.0 111.038 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.548 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.4 mp0 -91.1 -61.97 1.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.425 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -177.4 38.88 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.876 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.63 ' HD1' HG21 ' A' ' 37' ' ' VAL . 73.5 t80 -113.17 145.67 40.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.603 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 9.3 tp10 -145.06 147.03 32.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 179.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.566 HD11 ' CE3' ' A' ' 92' ' ' TRP . 59.1 mt -111.79 131.18 63.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.982 0.42 . . . . 0.0 110.297 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.468 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.5 t80 -114.87 101.37 8.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.203 177.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.553 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 18.4 mt-30 -92.96 136.19 33.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.873 -177.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 56.4 mt -117.59 113.2 41.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.144 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 43' ' ' THR . 9.3 m -91.09 119.04 30.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.362 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.3 mt -100.97 15.23 29.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.409 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.614 ' HB2' ' H ' ' A' ' 45' ' ' TYR . 4.7 t70 -71.85 166.98 20.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.494 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.95 -18.5 46.92 Favored Glycine 0 N--CA 1.441 -1.017 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.584 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.72 ' HB3' HD22 ' A' ' 46' ' ' ASN . 9.6 t70 -111.19 114.71 28.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.305 0.574 . . . . 0.0 110.951 -178.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.561 ' HB3' ' NH1' ' A' ' 96' ' ' ARG . 11.0 pt-20 -80.15 -20.65 44.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.362 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -46.14 81.17 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.565 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -70.2 -34.65 73.19 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.52 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 12.5 t90 -59.86 -59.96 4.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.939 173.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -63.25 -40.42 97.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.275 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 59.8 m -68.31 -34.09 75.51 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.406 -178.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -23.36 29.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.062 0.458 . . . . 0.0 110.365 178.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.545 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -81.38 -18.22 46.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.405 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -53.69 -44.58 69.88 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 111.321 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.06 16.45 9.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.851 -178.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.545 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 17.7 mt -86.63 139.09 33.37 Favored Pre-proline 0 N--CA 1.452 -0.374 0 CA-C-O 121.439 0.638 . . . . 0.0 111.895 -179.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.687 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 73.6 Cg_endo -79.13 -30.78 2.51 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.818 3.012 . . . . 0.0 113.485 -176.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.687 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.2 p90 -105.28 -163.26 0.93 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.124 -173.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.64 127.39 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -177.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.8 t -129.67 115.91 18.05 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.6 m -121.95 177.96 3.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.5 -176.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.561 ' NH1' ' HB3' ' A' ' 80' ' ' GLU . 32.5 ttp180 -129.93 139.14 51.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.571 0.224 . . . . 0.0 110.593 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.496 ' HA ' HD21 ' A' ' 20' ' ' LEU . 18.4 t70 -83.32 151.07 25.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.942 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.22 -25.29 34.3 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -104.83 -12.78 16.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -173.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.73 -87.49 0.17 Allowed Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.972 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -107.22 -9.98 15.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.006 0.431 . . . . 0.0 110.973 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -103.01 22.62 13.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.114 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.439 ' HB2' HG13 ' A' ' 106' ' ' ILE . 2.2 m -69.25 133.63 48.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.067 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.536 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 14.5 m -57.1 -33.35 67.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.311 176.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -56.35 -48.07 77.54 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.393 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.439 HG13 ' HB2' ' A' ' 103' ' ' SER . 41.9 mt -55.53 -37.42 45.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.666 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 32.8 t -77.92 -22.18 50.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.857 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.9 mt -80.3 -30.65 38.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.469 -177.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.469 ' OH ' HD12 ' A' ' 18' ' ' ILE . 82.7 m-85 -85.46 -19.92 30.52 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.033 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.424 ' C ' HD21 ' A' ' 110' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--N 1.333 -0.152 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -162.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.715 HD22 ' HB3' ' A' ' 42' ' ' PHE . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.29 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -74.74 158.3 99.0 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 124.039 -1.234 . . . . 0.0 112.015 0.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 42' ' ' PHE . 13.6 m -125.86 155.03 41.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.037 0.446 . . . . 0.0 111.375 -173.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.582 HG22 HD11 ' A' ' 39' ' ' LEU . 5.5 p -144.08 143.48 23.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.31 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.582 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 75.9 m-85 -136.07 162.37 33.08 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.758 HD11 HD13 ' A' ' 136' ' ' LEU . 27.3 tp -111.06 143.66 41.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.512 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 53.5 t -133.84 126.6 51.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.532 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.685 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.5 p30 -83.29 167.97 17.12 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 49.2 ptt85 -63.97 1.57 0.65 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -168.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -98.5 7.06 46.64 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.578 HD22 ' HB3' ' A' ' 30' ' ' LEU . 2.7 t-20 60.99 57.33 2.58 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.845 -170.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.685 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 39.8 mt-10 -129.27 145.27 51.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.355 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.04 110.93 4.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.277 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 7.7 m -80.51 -47.6 14.01 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.693 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.21 165.81 10.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.212 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.608 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 12.1 mpt_? -92.2 162.09 14.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 175.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.06 -44.82 92.91 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 121.485 -0.388 . . . . 0.0 112.845 -176.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.608 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.2 OUTLIER -68.88 -23.07 64.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.155 0.502 . . . . 0.0 110.481 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -92.68 -1.87 56.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.95 -176.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.601 HG23 HD12 ' A' ' 136' ' ' LEU . 96.5 mt -99.54 99.85 9.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.558 0.694 . . . . 0.0 110.302 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.417 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 13.1 ptmm? -60.51 -36.38 78.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.065 176.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.417 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 23.5 t70 -166.0 116.75 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.353 -176.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.758 HD13 HD11 ' A' ' 119' ' ' LEU . 1.8 tp -75.96 -26.66 57.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.57 -175.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -54.89 -53.43 55.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.719 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -58.53 -51.1 71.31 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.029 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.627 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.66 -54.54 42.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.905 -173.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.772 HD11 HD12 ' A' ' 60' ' ' LEU . 38.5 mt -63.33 -35.23 71.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.796 0.331 . . . . 0.0 111.008 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -62.39 -49.8 74.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.006 0.431 . . . . 0.0 110.462 178.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.93 -23.73 63.26 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.5 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 78.4 mt -66.85 -40.26 87.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.104 0.478 . . . . 0.0 110.103 173.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 96.7 mt . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.823 177.73 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.6 tp . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 120.921 0.391 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.47 HD11 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -100.81 103.68 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.49 108.52 2.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.335 0.588 . . . . 0.0 110.521 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 29' ' ' SER . 19.4 mm -87.15 124.2 40.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.645 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.564 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 11.0 mt-30 -120.86 100.43 7.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.89 0.376 . . . . 0.0 111.149 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.3 mt -142.03 153.88 44.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.225 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.55 ' HA ' ' O ' ' A' ' 26' ' ' ASN . 92.6 mttt -79.81 144.54 33.44 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.244 0.545 . . . . 0.0 110.528 178.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.553 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 3.3 p-10 -90.55 -169.84 2.53 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.04 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.498 ' CD2' ' HA ' ' A' ' 88' ' ' ASP . 37.9 tp -59.0 -36.4 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.42 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.423 ' HB2' HD21 ' A' ' 26' ' ' ASN . 91.6 mttt -69.71 -24.59 63.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.166 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.63 15.22 21.41 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.218 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.55 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 53.7 m-80 -99.51 122.52 42.71 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 17.0 m -66.72 106.87 1.96 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 172.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.564 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -86.82 142.43 28.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.082 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.538 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 73.8 p -121.72 156.95 32.01 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 172.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.589 ' HB3' HD22 ' A' ' 124' ' ' ASN . 53.7 mt -74.38 -27.02 60.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.091 0.472 . . . . 0.0 109.868 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.8 p -67.81 -14.79 63.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.187 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -91.28 -40.25 11.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 0.0 109.446 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.544 HD21 HG13 ' A' ' 38' ' ' VAL . 3.4 tp -77.11 3.65 12.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.346 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.46 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 36.9 ttpt -61.22 -18.42 58.23 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.436 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -71.73 -12.39 74.22 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.588 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -123.7 -177.89 3.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.98 0.419 . . . . 0.0 110.103 177.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.671 HG21 ' HD1' ' A' ' 69' ' ' PHE . 5.5 m -93.71 126.75 46.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 167.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 22.1 t -102.16 129.45 53.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.255 0.55 . . . . 0.0 112.132 -165.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.715 HD11 ' HZ ' ' A' ' 69' ' ' PHE . 6.2 tt -92.87 110.06 21.51 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 171.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.604 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 35.0 mm -84.74 106.15 14.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.99 0.424 . . . . 0.0 110.31 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.637 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 5.4 t70 -104.14 134.61 47.11 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.123 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -119.54 108.91 15.09 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.482 ' O ' ' HA ' ' A' ' 75' ' ' SER . 6.4 t -143.85 -175.45 4.59 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.219 0.533 . . . . 0.0 110.75 -174.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.731 HG11 ' HB2' ' A' ' 47' ' ' ASN . 2.5 p -145.12 128.15 10.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.653 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.522 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 30.1 m-85 -78.12 79.4 4.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.853 0.835 . . . . 0.0 109.807 178.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 176.1 -27.56 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 113.543 -1.662 . . . . 0.0 109.687 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.731 ' HB2' HG11 ' A' ' 44' ' ' VAL . 41.7 t-20 -73.21 135.33 44.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.729 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.82 68.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.345 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.21 -24.43 63.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.8 m -63.29 -28.98 70.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -176.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.38 -59.62 4.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.833 0.349 . . . . 0.0 111.256 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.05 -32.72 73.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.922 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.416 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 67.8 t60 -62.46 -42.96 99.84 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.022 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -70.04 -21.59 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.662 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.3 -44.02 65.96 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 177.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.3 75.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.36 0.6 . . . . 0.0 110.091 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.454 ' HB3' HD12 ' A' ' 71' ' ' ILE . 82.9 mt -65.96 -40.61 91.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.837 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 28.5 tpt180 -60.68 -28.82 68.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.22 177.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.55 -56.97 4.14 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 122.528 1.156 . . . . 0.0 108.148 -171.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.68 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -57.91 -32.48 67.79 Favored 'General case' 0 N--CA 1.425 -1.68 0 CA-C-N 112.348 -2.205 . . . . 0.0 111.515 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -75.65 -44.43 42.6 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.293 0.568 . . . . 0.0 109.647 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.514 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 15.1 t30 -59.75 -26.11 65.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.866 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -83.55 -61.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.701 -1.136 . . . . 0.0 112.434 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -105.69 -7.2 18.58 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -163.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.557 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.17 -35.37 69.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.12 0.418 . . . . 0.0 111.93 -177.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 m -66.21 -12.44 56.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.183 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -106.27 17.58 23.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.173 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.02 46.39 3.11 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.113 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.715 ' HZ ' HD11 ' A' ' 39' ' ' LEU . 46.9 t80 -120.8 136.24 54.95 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -142.59 142.79 32.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.193 0.52 . . . . 0.0 110.277 -176.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.474 HG23 HD22 ' A' ' 39' ' ' LEU . 60.0 mt -102.52 132.66 48.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.3 -176.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.478 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.7 t80 -115.7 101.2 8.62 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.676 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.637 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 2.0 mt-30 -90.72 128.08 36.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.469 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.3 mt -109.01 109.36 28.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.706 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 43' ' ' THR . 1.1 m -93.94 142.1 27.76 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.454 -178.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.404 HD13 HD22 ' A' ' 114' ' ' LEU . 45.1 mt -115.73 27.79 9.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.835 0.35 . . . . 0.0 110.96 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -84.1 178.48 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.871 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -137.73 35.43 2.05 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.983 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -138.36 134.14 33.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.984 0.421 . . . . 0.0 110.363 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -77.45 -31.42 53.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 51.0 m80 -68.79 -51.88 36.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.439 -167.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -71.49 -44.55 64.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.522 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 56.7 t90 -59.68 -49.6 77.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.491 -179.221 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 51.9 tttm -61.33 -61.72 2.34 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -177.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.8 m -55.44 -38.77 69.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.037 -173.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.479 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.4 m -74.48 -39.51 62.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.421 -177.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.44 -20.87 26.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.062 0.458 . . . . 0.0 111.458 -174.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.532 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -60.0 -35.54 75.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.532 -176.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -96.26 8.52 43.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.732 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 86' ' ' SER . 25.6 mt -93.82 149.05 36.4 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-O 121.249 0.547 . . . . 0.0 111.55 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.548 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 98.6 Cg_endo -74.32 -56.96 0.07 OUTLIER 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.59 2.86 . . . . 0.0 113.86 -175.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.548 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.5 p90 -83.37 -166.5 1.39 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.946 -169.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -87.52 133.32 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.813 -171.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 83.3 m -133.14 110.66 10.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.904 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.553 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 16.0 m -116.34 163.34 13.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.928 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -129.98 144.04 51.12 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.445 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -76.48 162.03 28.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.103 178.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.54 -34.95 65.45 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -177.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.421 HD21 ' HA ' ' A' ' 99' ' ' ASN . 1.0 OUTLIER -122.43 -11.27 8.34 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.751 -174.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.76 -113.72 3.82 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.252 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.31 5.58 4.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.851 0.358 . . . . 0.0 111.892 -174.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -110.29 9.51 23.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.973 0.416 . . . . 0.0 110.206 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 14.4 t -63.83 130.2 43.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.127 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.7 m -58.49 -28.95 65.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.699 -177.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.475 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 80.3 m-85 -61.54 -36.9 81.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.007 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.08 -34.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.603 -175.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 41.2 m -80.09 -18.6 49.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.921 0.391 . . . . 0.0 111.115 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.4 mt -81.0 -33.44 33.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.07 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.475 ' HE2' ' HB3' ' A' ' 105' ' ' TYR . 78.3 m-85 -83.76 -9.43 58.81 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.81 178.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 CA--C 1.516 -0.343 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 -168.261 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.554 ' CD2' ' HA ' ' A' ' 115' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.413 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.554 ' HA ' ' CD2' ' A' ' 114' ' ' LEU . 7.5 Cg_exo -71.24 162.83 87.21 Favored 'Cis proline' 0 C--N 1.352 0.722 0 C-N-CA 124.64 -0.983 . . . . 0.0 113.409 1.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 49.2 m -143.82 173.85 11.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.386 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.83 156.41 17.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.449 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.604 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 78.3 m-85 -146.36 158.68 43.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.757 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 17.7 tp -112.57 145.31 40.56 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.924 -177.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.6 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 34.6 t -138.5 126.12 28.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.645 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -80.92 168.26 18.93 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -76.72 16.3 0.53 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -172.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -105.8 10.59 32.58 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 167.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.589 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.9 t-20 56.48 63.75 1.88 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.908 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.6 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 46.1 mt-10 -127.46 140.87 51.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.673 176.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.5 tt -69.68 107.75 3.58 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.757 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 52.6 m -74.53 -52.98 10.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.335 -177.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -165.56 164.5 19.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.116 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.573 ' O ' HG13 ' A' ' 133' ' ' ILE . 99.4 mtt180 -102.06 151.62 21.93 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.448 ' C ' ' H ' ' A' ' 132' ' ' ASN . . . -54.83 155.62 8.39 Favored Glycine 0 N--CA 1.452 -0.237 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 173.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' A' ' 130' ' ' GLY . 26.2 mm-40 71.84 -40.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.119 0.568 . . . . 0.0 110.742 -172.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.472 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.8 OUTLIER -80.39 -29.86 37.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.954 0.407 . . . . 0.0 110.026 177.131 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.573 HG13 ' O ' ' A' ' 129' ' ' ARG . 51.3 mt -59.52 -44.32 92.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.807 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 132' ' ' ASN . 50.9 mttp 74.29 -58.47 0.58 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.428 0.691 . . . . 0.0 110.851 179.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -139.77 110.47 6.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.541 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.879 HD13 HD11 ' A' ' 140' ' ' ILE . 0.3 OUTLIER -77.11 -28.01 54.25 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.11 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.406 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.0 t70 -57.21 -52.27 65.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.693 0.282 . . . . 0.0 111.012 -172.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.46 -34.97 79.13 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.015 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.582 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -63.26 -52.36 62.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.694 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.879 HD11 HD13 ' A' ' 136' ' ' LEU . 30.1 mt -65.15 -40.04 87.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -62.75 -44.22 96.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.845 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -72.02 -19.7 61.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 79.1 mt -68.48 -39.76 81.22 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.637 0.732 . . . . 0.0 109.349 171.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.4 mt . . . . . 0 C--N 1.321 -0.668 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.918 177.389 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.7 tp . . . . . 0 N--CA 1.443 -0.823 0 CA-C-O 121.286 0.565 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.453 ' O ' HD12 ' A' ' 30' ' ' LEU . 95.0 mt -87.6 101.94 11.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.885 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -68.73 107.87 3.18 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.803 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 29' ' ' SER . 23.4 mm -87.93 113.8 25.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.222 -178.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.495 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 80.3 mt-30 -108.78 100.26 9.51 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.377 0.608 . . . . 0.0 110.864 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.622 ' HB2' HG11 ' A' ' 95' ' ' VAL . 45.5 mt -137.99 159.98 40.58 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 41.6 mttp -89.01 135.4 33.57 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.154 0.502 . . . . 0.0 111.532 -177.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.547 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 21.5 p30 -81.79 -167.26 1.45 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.587 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.534 HD23 ' HB3' ' A' ' 87' ' ' ALA . 91.1 mt -50.33 -35.98 30.08 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.601 ' HB2' ' HZ1' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -83.86 -6.54 59.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.718 -176.502 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.85 12.76 70.96 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -173.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.545 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.8 OUTLIER -88.06 112.96 23.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.262 -0.469 . . . . 0.0 110.181 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.581 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.0 m -61.88 111.38 1.87 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.154 0.502 . . . . 0.0 111.144 177.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 14.4 mmt180 -90.64 142.52 27.67 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.55 173.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.495 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 79.6 p -119.22 165.6 14.03 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 171.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.684 ' HB3' HD22 ' A' ' 124' ' ' ASN . 62.8 mt -79.61 -24.93 41.63 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 p -68.09 -18.26 64.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.938 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -83.3 -41.36 18.37 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.66 0.743 . . . . 0.0 109.449 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.713 HD21 HG13 ' A' ' 38' ' ' VAL . 4.6 tp -76.1 -7.19 54.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.727 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.61 ' HB3' ' NZ ' ' A' ' 34' ' ' LYS . 1.1 ttpm? -61.17 99.83 0.11 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.128 175.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.88 -30.76 0.21 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -174.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.601 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 86.4 mttt -113.2 177.5 4.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 167.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.808 HG23 ' HD1' ' A' ' 69' ' ' PHE . 13.0 m -82.35 130.72 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.713 HG13 HD21 ' A' ' 33' ' ' LEU . 43.6 t -101.72 124.03 55.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.178 0.514 . . . . 0.0 111.751 -167.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.538 HD23 ' HZ ' ' A' ' 69' ' ' PHE . 12.4 tp -94.28 112.6 24.4 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.765 175.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.599 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.4 mm -85.2 105.27 13.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.488 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 29.2 t70 -107.8 110.83 22.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.744 -178.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.401 ' HB3' HD12 ' A' ' 114' ' ' LEU . 36.1 m-85 -95.05 105.18 17.08 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.531 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.6 t -137.56 -175.84 4.2 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.402 0.62 . . . . 0.0 111.563 -170.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.548 HG21 ' HB3' ' A' ' 77' ' ' ASP . 0.2 OUTLIER -143.0 122.39 8.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.782 178.654 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.685 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 49.4 m-85 -81.27 79.97 7.8 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 9.7 t30 174.79 -30.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.846 175.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.443 ' CB ' HG13 ' A' ' 44' ' ' VAL . 38.4 t-20 -66.82 134.53 52.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.507 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.27 -30.87 70.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.305 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.8 tpt -64.29 -30.1 71.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.906 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 m -68.46 -28.27 66.9 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.356 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.91 -53.75 45.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.864 0.364 . . . . 0.0 110.929 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.78 63.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.198 0.523 . . . . 0.0 110.604 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.485 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.1 t60 -65.3 -44.23 88.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.041 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.454 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.6 m-20 -66.3 -27.15 67.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.647 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.44 -55.11 34.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.262 0.553 . . . . 0.0 109.839 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.57 -32.92 73.03 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.845 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.1 mt -64.45 -39.48 93.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.864 176.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -62.35 -33.34 74.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.492 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.55 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 2.2 tt0 -71.77 -52.61 16.79 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.823 HD13 HD11 ' A' ' 140' ' ' ILE . 1.5 mm? -51.69 -34.97 40.82 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 112.952 -1.931 . . . . 0.0 111.577 177.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -75.9 -41.52 51.71 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.189 0.518 . . . . 0.0 110.065 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.415 HD21 ' HA ' ' A' ' 62' ' ' ASN . 8.9 m120 -65.28 -21.43 66.72 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.832 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.592 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 36.3 mttm -80.99 -61.73 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.602 -178.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.435 ' HE1' ' HG3' ' A' ' 141' ' ' LYS . 71.1 m-85 -111.21 -10.91 14.27 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -163.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.573 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.88 -31.31 71.58 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.307 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.5 m -64.18 -24.88 67.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.978 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -96.12 -6.93 37.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.027 0.442 . . . . 0.0 110.67 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.418 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 117.27 64.41 0.33 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.638 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.808 ' HD1' HG23 ' A' ' 37' ' ' VAL . 34.4 t80 -134.44 141.93 46.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.625 ' HG2' HD12 ' A' ' 33' ' ' LEU . 7.9 tp10 -140.24 148.6 41.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.351 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.562 ' HB ' ' CG ' ' A' ' 92' ' ' TRP . 48.0 mt -112.51 124.93 69.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.018 0.437 . . . . 0.0 109.963 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.569 ' CE1' HG21 ' A' ' 95' ' ' VAL . 88.2 t80 -109.86 100.43 9.41 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.488 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.4 mt-30 -92.2 135.43 34.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.092 0.472 . . . . 0.0 111.29 -178.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 68.2 mt -117.95 110.77 31.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.458 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.714 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 34.6 p -85.35 136.95 33.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.689 0.28 . . . . 0.0 111.114 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 101' ' ' ALA . 50.8 mt -105.39 13.74 29.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.812 0.339 . . . . 0.0 110.829 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.714 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 2.2 p-10 -86.47 163.04 17.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.969 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -98.09 -29.06 7.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.768 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.475 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 13.5 t0 -76.45 110.19 10.79 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.397 0.618 . . . . 0.0 110.669 -178.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.589 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 32.1 tt0 -70.93 -19.94 62.52 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.334 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . 0.475 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.0 OUTLIER -71.53 -45.04 63.48 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.835 -175.756 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -71.14 -44.95 64.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.977 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.497 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 39.2 t90 -55.9 -42.84 76.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.354 172.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.589 ' HB2' ' O ' ' A' ' 80' ' ' GLU . 11.5 tppt? -60.91 -57.47 12.52 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.96 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 p -65.14 -41.42 94.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.296 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.2 m -67.69 -37.46 82.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.424 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.534 ' HB3' HD23 ' A' ' 23' ' ' LEU . . . -86.58 -17.74 33.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.604 -177.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -50.18 -35.04 24.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.039 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -109.76 16.04 22.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.536 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 87' ' ' ALA . 27.8 mt -89.63 146.88 36.53 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.144 0.497 . . . . 0.0 111.525 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.67 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 93.1 Cg_endo -79.96 -40.49 0.23 Allowed 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 123.694 2.929 . . . . 0.0 114.027 -176.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.67 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.0 p90 -96.15 -168.09 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.783 0.325 . . . . 0.0 111.627 -170.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.401 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 24.8 t -81.61 120.29 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 121.148 0.499 . . . . 0.0 110.528 -171.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 35.0 m -116.3 106.54 13.77 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.956 -176.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.622 HG11 ' HB2' ' A' ' 20' ' ' LEU . 7.9 t -121.29 159.69 23.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.463 -172.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.566 HH12 ' HB2' ' A' ' 80' ' ' GLU . 54.0 ttp180 -120.34 141.78 49.73 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.763 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.532 ' HA ' HD12 ' A' ' 20' ' ' LEU . 30.4 t70 -73.2 160.53 31.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.321 177.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.79 -28.43 33.21 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -174.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.459 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 33.4 t30 -122.49 -12.69 8.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 112.46 -172.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.55 84.72 0.23 Allowed Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.651 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.417 ' HA ' HD13 ' A' ' 76' ' ' LEU . . . 75.19 -32.78 0.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.46 0.704 . . . . 0.0 111.926 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.459 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 52.3 m-85 -86.28 37.04 0.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.066 0.46 . . . . 0.0 110.016 176.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.44 ' HB3' HG13 ' A' ' 106' ' ' ILE . 23.1 t -87.22 136.73 32.82 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.346 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.8 m -61.83 -29.25 70.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.06 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -64.79 -41.42 95.84 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.843 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.44 HG13 ' HB3' ' A' ' 103' ' ' SER . 71.7 mt -56.81 -38.78 60.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.165 -178.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 36.1 t -68.91 -28.62 66.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.758 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.43 -26.68 61.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.94 0.4 . . . . 0.0 110.56 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -83.85 -1.55 54.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.751 0 CA-C-O 121.805 0.812 . . . . 0.0 110.198 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.564 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 53.8 mt . . . . . 0 CA--C 1.533 0.294 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.564 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.18 158.89 91.82 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.614 0.898 . . . . 0.0 113.582 1.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.1 m -155.22 164.3 38.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.012 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.43 154.05 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.599 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.1 m-85 -132.35 161.86 32.52 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.671 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.4 tp -110.85 131.67 54.85 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.946 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 23.0 t -129.31 127.4 65.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 174.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.449 ' HB3' HD22 ' A' ' 143' ' ' LEU . 8.0 p30 -83.78 170.76 13.82 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.029 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -60.81 -12.67 11.54 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 124.272 0.983 . . . . 0.0 113.544 -164.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -95.71 13.46 26.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.684 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.6 t-20 61.01 54.78 3.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.841 -174.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.471 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.9 mm-40 -122.25 137.36 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.54 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 126' ' ' LEU . 10.0 mt -68.49 112.27 5.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 0.0 110.437 175.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.671 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 24.4 m -81.37 -55.02 4.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.005 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -168.33 172.39 8.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.46 -175.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.677 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -93.94 161.88 14.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 108.96 176.001 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.499 ' HA2' HD11 ' A' ' 133' ' ' ILE . . . -48.05 -48.99 24.91 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 114.7 0.64 . . . . 0.0 114.7 -172.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.85 -26.87 59.99 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 117.028 0.414 . . . . 0.0 110.739 -176.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.424 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -72.35 -34.18 67.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.877 175.416 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.929 HG22 ' HG ' ' A' ' 136' ' ' LEU . 49.1 mt -69.46 -40.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.56 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.578 ' HG3' ' C ' ' A' ' 133' ' ' ILE . 0.0 OUTLIER 48.45 -86.51 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.287 0.992 . . . . 0.0 112.023 -173.273 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -88.43 84.78 6.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.093 -176.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.929 ' HG ' HG22 ' A' ' 133' ' ' ILE . 4.6 mp -60.6 -32.53 71.65 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.719 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -52.85 -56.09 18.36 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.812 0.339 . . . . 0.0 110.365 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.33 -41.64 93.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.777 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -58.09 -54.88 42.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.614 -177.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.823 HD11 HD13 ' A' ' 60' ' ' LEU . 35.8 mt -65.35 -35.23 74.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.862 0.363 . . . . 0.0 110.948 -177.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.435 ' HG3' ' HE1' ' A' ' 64' ' ' TYR . 3.5 ttmp? -60.15 -42.52 95.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.156 0.503 . . . . 0.0 109.991 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -82.84 -18.4 40.54 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.861 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 55.7 mt -62.2 -38.42 89.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.419 0.628 . . . . 0.0 109.544 170.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 44.5 mt . . . . . 0 N--CA 1.447 -0.583 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.158 179.423 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.447 -0.614 0 CA-C-O 121.057 0.456 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.42 ' N ' HD13 ' A' ' 16' ' ' ILE . 4.1 mp -94.39 102.73 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 168.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.92 132.47 44.4 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.4 mt -113.61 105.54 18.94 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.25 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.417 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.0 OUTLIER -93.88 101.44 13.52 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.267 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.492 ' HB2' HG11 ' A' ' 95' ' ' VAL . 78.4 mt -137.54 155.66 48.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.4 mtmt -89.0 137.99 31.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.495 0.664 . . . . 0.0 111.425 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.592 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -87.64 -169.89 2.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.87 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.676 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 36.5 tp -48.33 -39.52 22.27 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.603 0.761 . . . . 0.0 112.716 -178.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.9 mtmm -74.98 -13.6 60.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.999 0.428 . . . . 0.0 111.738 -177.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.63 17.25 55.17 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 -175.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.464 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.9 OUTLIER -99.56 127.56 45.64 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.667 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.5 m -67.97 113.78 5.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.454 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 16.5 mmm180 -92.45 142.29 27.58 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.428 ' O ' ' HB3' ' A' ' 32' ' ' ASP . 2.0 m -134.31 163.66 29.15 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 174.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.481 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 65.4 mt -80.08 -32.88 39.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.553 -172.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.7 p -64.21 -14.32 54.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.018 0.437 . . . . 0.0 111.116 173.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t0 -82.6 -45.07 15.03 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -76.35 0.13 20.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.473 -1.24 . . . . 0.0 110.659 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.607 ' HB3' ' HZ2' ' A' ' 34' ' ' LYS . 7.4 ttpm? -58.26 134.58 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.736 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.69 -29.88 5.5 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -174.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.569 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 61.4 mttm -112.38 166.15 11.55 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.753 HG22 ' HD1' ' A' ' 69' ' ' PHE . 8.5 m -84.27 124.44 39.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.613 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 99.4 t -102.06 132.03 48.86 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 121.641 0.734 . . . . 0.0 111.045 -169.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.617 HD21 HG23 ' A' ' 71' ' ' ILE . 6.4 tt -94.38 104.27 16.25 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 172.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.435 HG13 ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -88.46 104.34 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.281 178.339 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.545 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.2 t70 -103.26 142.02 34.9 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.065 -175.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -124.3 95.93 4.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 173.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.429 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.7 t -123.7 -175.71 3.28 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.296 -174.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.501 ' CG1' ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -137.78 111.51 8.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.08 0.467 . . . . 0.0 110.628 178.85 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.994 ' HH ' HD11 ' A' ' 90' ' ' LEU . 41.7 m-85 -72.55 79.18 1.06 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 51.4 t30 172.51 -25.59 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.224 -177.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.501 ' HB2' ' CG1' ' A' ' 44' ' ' VAL . 5.6 t-20 -82.29 150.15 27.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.643 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.02 -30.95 62.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -71.77 -20.17 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.75 -176.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.0 m -63.97 -24.69 67.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.623 0.249 . . . . 0.0 111.329 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.05 -50.23 74.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.802 0.334 . . . . 0.0 111.269 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.61 -31.94 60.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.103 0.478 . . . . 0.0 110.814 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -63.72 -45.11 91.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.715 179.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.71 -18.78 62.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.836 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.416 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -73.85 -44.31 55.92 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.95 -37.77 77.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.395 0.616 . . . . 0.0 109.882 175.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.87 -40.31 91.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.926 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.463 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 13.1 tpt180 -56.14 -35.96 67.72 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.958 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.55 -50.96 11.49 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -172.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.915 HD12 HD13 ' A' ' 140' ' ' ILE . 1.9 mm? -55.97 -31.34 62.9 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 113.262 -1.79 . . . . 0.0 111.441 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.417 ' HD1' HG13 ' A' ' 71' ' ' ILE . 23.9 t80 -82.83 -44.03 15.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.387 0.613 . . . . 0.0 109.876 -178.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 29.1 t30 -60.65 -24.82 65.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.116 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -85.95 -60.67 1.95 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.815 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.57 -12.51 16.4 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -164.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.41 -31.77 70.7 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -174.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 m -60.35 -28.73 68.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.168 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.516 ' HG3' HD11 ' A' ' 144' ' ' LEU . 9.2 pt20 -108.68 29.77 7.12 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 99.02 48.62 1.71 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.067 -1.063 . . . . 0.0 112.852 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.753 ' HD1' HG22 ' A' ' 37' ' ' VAL . 37.3 t80 -132.23 140.5 48.7 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.413 ' OE1' HG21 ' A' ' 93' ' ' VAL . 0.3 OUTLIER -140.62 151.2 44.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.493 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.617 HG23 HD21 ' A' ' 39' ' ' LEU . 65.2 mt -114.24 111.0 34.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.714 0.769 . . . . 0.0 110.394 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.527 ' CE1' HG21 ' A' ' 95' ' ' VAL . 91.5 t80 -96.56 99.17 10.82 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.545 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 8.4 tt0 -100.96 114.35 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.349 -171.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 50.0 mt -96.71 124.6 49.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.218 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.497 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 27.9 t -96.93 137.95 35.23 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.904 0.383 . . . . 0.0 110.472 177.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 31.0 mt -112.08 34.32 4.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.653 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.404 ' OD2' ' HD3' ' A' ' 96' ' ' ARG . 3.6 p30 -82.92 -176.16 6.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.449 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.7 35.98 1.88 Allowed Glycine 0 N--CA 1.444 -0.773 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.45 176.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -145.35 115.83 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.359 0.599 . . . . 0.0 110.995 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.473 ' HA ' HH12 ' A' ' 96' ' ' ARG . 4.9 tp10 -64.65 -36.0 82.84 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.096 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -61.51 -56.38 20.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.585 -170.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -68.55 -41.05 80.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.76 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.676 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 53.2 t90 -60.81 -55.12 36.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.545 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -57.32 -46.93 82.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.899 0.381 . . . . 0.0 111.362 -176.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 21.3 m -70.2 -42.47 72.3 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.804 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.6 t -75.43 -42.38 53.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.05 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.577 ' HB3' ' SG ' ' A' ' 94' ' ' CYS . . . -64.59 -32.13 73.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.863 0.363 . . . . 0.0 110.99 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.53 -27.84 68.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.413 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.61 -1.99 42.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.528 -176.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.994 HD11 ' HH ' ' A' ' 45' ' ' TYR . 26.8 mt -96.7 148.59 34.66 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 121.171 0.51 . . . . 0.0 112.229 -176.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.583 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 89.4 Cg_endo -74.41 -51.79 0.13 Allowed 'Trans proline' 0 N--CA 1.478 0.611 0 C-N-CA 124.128 3.219 . . . . 0.0 114.423 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.583 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -83.57 -178.95 7.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.627 -172.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.413 HG21 ' OE1' ' A' ' 70' ' ' GLU . 99.1 t -70.2 125.19 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 121.294 0.568 . . . . 0.0 111.052 -173.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.577 ' SG ' ' HB3' ' A' ' 87' ' ' ALA . 1.8 p -113.97 105.21 12.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.396 -176.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.592 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 1.7 t -115.36 161.51 14.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.379 -172.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.473 HH12 ' HA ' ' A' ' 80' ' ' GLU . 46.9 ttp180 -140.49 140.12 35.25 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.255 170.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -93.94 149.33 21.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.63 175.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.65 -1.75 47.84 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -173.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -110.01 -12.49 14.53 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.106 -0.371 . . . . 0.0 111.702 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.21 -117.1 8.66 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.119 -178.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -91.63 25.15 2.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.86 0.362 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -130.22 17.27 5.52 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.419 178.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.538 ' HB2' HG13 ' A' ' 106' ' ' ILE . 10.5 m -61.96 134.55 56.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.204 -178.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.473 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 4.0 m -55.78 -35.22 66.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.012 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -57.08 -47.56 80.72 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.538 HG13 ' HB2' ' A' ' 103' ' ' SER . 68.2 mt -57.93 -37.76 62.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.928 -177.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 16.0 m -70.33 -36.19 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.898 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.5 mt -66.01 -34.87 79.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.305 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -71.44 -29.75 65.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.667 0.27 . . . . 0.0 110.853 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -163.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.541 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 3.6 mm? . . . . . 0 C--O 1.236 0.355 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.541 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.7 Cg_endo -73.36 153.5 99.17 Favored 'Cis proline' 0 C--N 1.35 0.607 0 C-N-CA 123.811 -1.329 . . . . 0.0 113.163 0.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.441 ' HB2' HD13 ' A' ' 114' ' ' LEU . 30.4 m -151.13 178.57 9.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.383 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.492 HG12 ' HA3' ' A' ' 130' ' ' GLY . 4.3 p -139.36 162.21 27.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.435 ' HB2' HG13 ' A' ' 40' ' ' ILE . 91.6 m-85 -144.27 157.17 44.42 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.862 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.7 tp -112.77 144.92 41.48 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.079 -0.248 . . . . 0.0 110.681 -177.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.613 ' CG2' ' HB ' ' A' ' 38' ' ' VAL . 5.1 m -141.67 140.5 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 120.853 0.359 . . . . 0.0 110.9 169.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.623 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 5.3 p30 -80.49 173.83 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.582 ' HG3' HG11 ' A' ' 37' ' ' VAL . 98.2 mtt180 -52.55 -30.03 28.53 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.147 1.165 . . . . 0.0 114.147 -171.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -76.79 4.93 8.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.094 0.474 . . . . 0.0 110.243 177.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.481 ' OD1' ' HB3' ' A' ' 30' ' ' LEU . 3.2 m-80 58.44 61.95 2.11 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.221 -173.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.623 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 46.1 mt-10 -124.94 132.18 53.32 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.85 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.536 ' HA ' HG13 ' A' ' 120' ' ' VAL . 1.2 tt -58.91 113.39 2.05 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 123.895 0.747 . . . . 0.0 110.504 -174.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.862 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.6 m -77.88 -55.29 5.43 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.581 -179.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.577 ' HB3' HD22 ' A' ' 132' ' ' ASN . . . -172.71 171.48 4.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.299 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.596 ' HD3' ' OE2' ' A' ' 131' ' ' GLU . 57.9 mtt180 -90.48 144.91 25.33 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.11 -178.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.492 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -64.48 -17.77 62.55 Favored Glycine 0 C--N 1.319 -0.387 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 172.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.596 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 10.9 mt-10 -64.94 -24.71 67.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.099 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.584 ' OD1' ' HB2' ' A' ' 129' ' ' ARG . 1.6 p-10 -118.49 -23.14 7.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.562 179.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 129' ' ' ARG . 70.5 mt -79.41 101.85 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.919 0.39 . . . . 0.0 110.461 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.3 ptmm? -84.76 -32.35 23.47 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -121.61 93.29 3.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.536 ' O ' HG13 ' A' ' 140' ' ' ILE . 5.8 mp -75.85 -25.52 56.29 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.228 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.577 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.1 t70 -49.37 -58.01 5.88 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 123.433 0.458 . . . . 0.0 110.931 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -60.7 -42.98 98.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.813 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.506 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -57.81 -53.1 61.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.456 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.915 HD13 HD12 ' A' ' 60' ' ' LEU . 33.7 mt -64.54 -40.56 89.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.889 0.376 . . . . 0.0 110.949 -178.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -58.92 -47.28 85.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.436 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -68.41 -20.47 64.67 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.766 -177.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 87.5 mt -72.8 -40.81 65.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.263 0.554 . . . . 0.0 110.239 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.516 HD11 ' HG3' ' A' ' 67' ' ' GLN . 97.6 mt . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.334 -176.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.599 HD13 HD12 ' A' ' 30' ' ' LEU . 4.9 tp . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 121.232 0.539 . . . . 0.0 110.306 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.458 ' O ' HD11 ' A' ' 30' ' ' LEU . 3.4 mp -66.55 120.04 12.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.66 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.66 107.69 4.63 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.057 0.456 . . . . 0.0 110.017 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.654 ' O ' ' HA ' ' A' ' 29' ' ' SER . 12.9 mt -106.18 110.3 30.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.872 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.511 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 95.1 mt-30 -107.47 101.4 10.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.122 0.486 . . . . 0.0 111.33 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.568 ' HB2' HG11 ' A' ' 95' ' ' VAL . 28.4 mt -137.19 157.99 45.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.689 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 47.9 mttm -94.8 158.95 15.27 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.391 0.615 . . . . 0.0 111.675 -175.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -95.44 -169.74 2.03 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.39 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.682 HD12 ' HB2' ' A' ' 87' ' ' ALA . 6.4 mp -52.97 -41.5 64.62 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.6 0.562 . . . . 0.0 111.844 -176.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.546 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 67.5 mttm -81.3 -16.62 51.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.1 -175.061 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.47 6.88 40.81 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.959 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.546 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 2.2 m-80 -80.99 126.36 31.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.689 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.3 m -74.86 112.82 11.47 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.959 0.409 . . . . 0.0 110.637 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.552 ' HG3' HG13 ' A' ' 93' ' ' VAL . 3.6 mmm-85 -100.49 143.47 30.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.654 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.2 p -127.42 175.93 7.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.278 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.599 HD12 HD13 ' A' ' 15' ' ' ILE . 97.2 mt -78.9 -10.95 59.97 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.595 ' HA ' ' HB2' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -88.46 2.27 53.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.334 169.524 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 29' ' ' SER . 29.1 t70 -95.94 -33.51 12.15 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.894 HD12 HG21 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -111.47 18.24 19.33 Favored 'General case' 0 C--O 1.249 1.073 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.762 173.298 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.595 ' HB2' ' HA ' ' A' ' 31' ' ' THR . 56.4 tttp -70.93 66.64 0.38 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.202 179.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.41 -23.63 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.032 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.863 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.734 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -137.76 -174.41 3.77 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.95 174.62 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.698 HG21 ' H ' ' A' ' 122' ' ' ARG . 54.6 t -72.17 118.27 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -176.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.894 HG21 HD12 ' A' ' 33' ' ' LEU . 78.0 t -117.55 132.46 67.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-O 122.038 0.923 . . . . 0.0 113.257 -168.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.553 ' HB3' HG21 ' A' ' 71' ' ' ILE . 2.2 tt -81.14 123.49 28.47 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.274 171.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.559 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 5.6 mm -99.42 105.54 17.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 173.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.472 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 16.5 t70 -108.55 132.69 53.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.025 0.44 . . . . 0.0 111.582 -175.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.613 ' HB3' HD22 ' A' ' 114' ' ' LEU . 62.8 m-85 -121.64 109.82 15.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.529 174.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 t -150.06 176.82 10.45 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.637 HG22 ' HB2' ' A' ' 47' ' ' ASN . 17.8 m -119.59 113.27 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.64 175.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.821 ' CD1' ' HB2' ' A' ' 75' ' ' SER . 33.6 m-85 -67.72 84.77 0.2 Allowed 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.673 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.402 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 57.2 t30 174.04 -35.65 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.098 0.951 . . . . 0.0 109.228 -172.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.637 ' HB2' HG22 ' A' ' 44' ' ' VAL . 9.4 t-20 -85.07 143.09 29.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.265 -172.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.55 69.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.367 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.8 mtp -65.56 -24.33 67.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.184 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -81.47 -23.87 37.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.562 -176.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.58 -56.9 14.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.844 0.354 . . . . 0.0 110.827 -178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.78 -27.46 65.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.587 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.6 t60 -66.7 -45.64 78.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.614 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.49 ' HA ' HD11 ' A' ' 57' ' ' LEU . 5.4 m-20 -67.05 -27.91 67.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.23 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -61.13 -56.22 23.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.133 0.492 . . . . 0.0 109.896 176.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.418 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . -59.43 -33.38 71.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.021 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 96.3 mt -63.34 -40.8 98.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 110.136 176.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.867 HH21 ' HD3' ' A' ' 91' ' ' PRO . 14.5 ttm180 -64.89 -29.94 70.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.048 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -74.01 -51.82 14.69 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.448 ' CD1' ' HB3' ' A' ' 136' ' ' LEU . 22.7 mt -55.71 -35.91 66.6 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 111.742 -2.481 . . . . 0.0 111.336 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -73.02 -48.36 36.93 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.684 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -62.56 -22.35 66.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.637 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -79.32 -57.65 3.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.135 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.435 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 84.7 m-85 -112.6 -8.68 13.81 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -164.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.539 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.48 -43.0 83.74 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -173.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.4 m -67.84 -16.23 64.0 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.755 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.435 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.1 mp0 -93.88 -0.53 55.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 110.736 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.69 50.6 0.52 Allowed Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.498 -0.858 . . . . 0.0 111.814 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.539 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 80.8 t80 -130.45 136.14 48.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.122 0.487 . . . . 0.0 110.749 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.734 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.5 tp10 -135.7 159.94 40.08 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.461 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.553 HG21 ' HB3' ' A' ' 39' ' ' LEU . 48.5 mt -131.0 130.15 63.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.007 0.432 . . . . 0.0 110.231 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.815 ' HB2' HD21 ' A' ' 33' ' ' LEU . 77.1 t80 -117.79 101.17 8.1 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.472 ' HG3' ' HB3' ' A' ' 41' ' ' ASP . 57.8 tt0 -105.8 121.52 44.21 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.303 -172.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.403 HD11 ' HE2' ' A' ' 72' ' ' TYR . 60.0 mt -101.88 130.31 51.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.421 -178.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.821 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 35.7 t -102.99 112.33 25.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.128 172.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.787 HD12 HD23 ' A' ' 114' ' ' LEU . 2.3 pp -113.22 28.47 8.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.89 0.376 . . . . 0.0 111.201 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.518 ' HB2' ' HB ' ' A' ' 44' ' ' VAL . 19.0 t70 -65.89 -73.91 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.319 176.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.35 -27.58 1.68 Allowed Glycine 0 N--CA 1.44 -1.041 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.892 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -85.67 131.34 34.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.24 0.543 . . . . 0.0 111.572 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -79.14 -38.97 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.52 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -68.96 -39.97 79.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.858 -165.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -77.97 -34.73 50.84 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 -176.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.574 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 22.7 t90 -62.19 -57.6 10.89 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.604 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -64.54 -38.91 92.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.928 -0.309 . . . . 0.0 111.691 -171.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -67.18 -43.53 81.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.999 0.428 . . . . 0.0 110.977 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.559 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.9 m -70.55 -24.37 62.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.811 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.682 ' HB2' HD12 ' A' ' 23' ' ' LEU . . . -87.8 -25.66 23.24 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.506 0.669 . . . . 0.0 110.099 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.3 -13.63 62.24 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.572 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -103.36 -3.49 25.45 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.832 174.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 86' ' ' SER . 41.4 mt -94.03 148.94 36.1 Favored Pre-proline 0 N--CA 1.447 -0.622 0 CA-C-O 121.361 0.6 . . . . 0.0 111.649 -175.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.867 ' HD3' HH21 ' A' ' 58' ' ' ARG . 24.7 Cg_endo -90.54 -37.95 0.05 OUTLIER 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 124.156 3.237 . . . . 0.0 113.875 -173.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.616 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.8 p90 -87.57 -169.05 2.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.206 -171.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.552 HG13 ' HG3' ' A' ' 28' ' ' ARG . 38.0 t -78.89 99.39 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-O 121.087 0.47 . . . . 0.0 110.112 -173.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.575 ' HB2' HD12 ' A' ' 23' ' ' LEU . 22.1 m -97.57 113.19 24.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.603 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.608 HG23 ' CE1' ' A' ' 72' ' ' TYR . 1.9 t -119.45 153.19 22.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.511 -170.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.455 ' HB2' ' CE2' ' A' ' 83' ' ' TRP . 7.8 tmm_? -124.02 140.0 53.4 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.433 ' HA ' HD11 ' A' ' 20' ' ' LEU . 16.1 t70 -81.92 158.61 23.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 -173.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.36 -34.53 31.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.028 -175.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.32 -12.66 8.59 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.159 -174.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 80.27 -120.17 5.12 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.688 175.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.09 -6.17 32.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 111.55 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -104.15 16.97 25.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.133 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.499 ' HB3' HG13 ' A' ' 106' ' ' ILE . 24.2 t -65.08 133.1 50.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.49 -178.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.475 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 12.0 m -62.53 -26.91 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.186 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.434 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 88.5 m-85 -63.53 -42.63 98.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.982 0.42 . . . . 0.0 110.019 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.634 HD12 HD23 ' A' ' 76' ' ' LEU . 52.3 mt -52.94 -42.27 43.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.999 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.8 m -71.93 -20.39 61.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.341 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 104' ' ' SER . 97.6 mt -81.2 -38.48 26.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.661 0.267 . . . . 0.0 111.406 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.434 ' HE2' ' HB3' ' A' ' 105' ' ' TYR . 77.3 m-85 -79.55 -25.21 41.72 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.882 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.787 HD23 HD12 ' A' ' 76' ' ' LEU . 2.4 mp . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 111.473 0.175 . . . . 0.0 111.473 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.486 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 3.9 Cg_exo -72.38 166.86 79.03 Favored 'Cis proline' 0 C--N 1.353 0.801 0 C-N-CA 123.712 -1.37 . . . . 0.0 111.914 -0.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.4 m -145.17 157.32 44.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.89 -177.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.542 ' O ' ' HA3' ' A' ' 130' ' ' GLY . 1.3 p -134.98 155.43 38.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.559 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 89.7 m-85 -145.56 153.57 41.23 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.813 ' HB3' ' HB3' ' A' ' 127' ' ' SER . 8.5 tp -122.07 150.35 42.26 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.488 -1.285 . . . . 0.0 112.217 -178.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.54 HG12 ' HA ' ' A' ' 126' ' ' LEU . 13.7 m -136.93 143.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.749 169.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.571 ' ND2' ' HG3' ' A' ' 125' ' ' GLU . 5.0 p30 -110.48 153.79 24.55 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.698 ' H ' HG21 ' A' ' 37' ' ' VAL . 21.4 ttp-105 49.8 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.785 1.303 . . . . 0.0 113.173 167.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -97.56 30.54 2.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.768 -176.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.566 ' CB ' ' HG3' ' A' ' 34' ' ' LYS . 1.2 t-20 58.68 53.88 5.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.998 -178.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.571 ' HG3' ' ND2' ' A' ' 121' ' ' ASN . 1.6 pt-20 -109.08 128.73 55.24 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.379 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.54 ' HA ' HG12 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -52.07 116.4 2.17 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.688 0.618 . . . . 0.0 111.192 -173.619 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.813 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 24.8 t -71.76 -61.56 1.74 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.663 178.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.11 164.34 18.04 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.771 179.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.537 ' HB3' ' OE1' ' A' ' 131' ' ' GLU . 7.3 mmm180 -75.37 147.5 39.98 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 1.037 ' HA2' HG12 ' A' ' 133' ' ' ILE . . . -67.33 -21.74 72.43 Favored Glycine 0 CA--C 1.508 -0.385 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.985 -175.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.537 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.9 mp0 -67.1 -12.39 59.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.361 0.601 . . . . 0.0 109.547 173.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -117.62 -1.53 11.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.163 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 1.037 HG12 ' HA2' ' A' ' 130' ' ' GLY . 16.5 mm -84.39 94.79 3.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.402 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 14.7 ptmm? -50.27 -51.78 41.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.383 0.611 . . . . 0.0 110.206 176.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.402 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 4.8 m-20 -144.35 126.64 15.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.937 HD22 HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.85 -38.86 79.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.408 ' HB2' HD23 ' A' ' 60' ' ' LEU . 9.5 t70 -49.09 -58.42 4.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.771 176.064 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.01 -40.96 70.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.414 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.612 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.914 -175.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.702 HD12 HD13 ' A' ' 136' ' ' LEU . 24.1 mt -60.64 -46.08 96.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.691 0.758 . . . . 0.0 110.037 176.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.44 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 17.2 ttpt -56.99 -39.09 74.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.559 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.585 ' HE3' ' HA ' ' A' ' 139' ' ' ALA . 17.9 pttp -84.39 -19.94 32.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.526 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 13.8 mt -81.52 -29.56 33.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -175.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 87.0 mt . . . . . 0 C--N 1.32 -0.695 0 CA-C-O 121.356 0.598 . . . . 0.0 110.179 178.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.614 HG22 ' O ' ' A' ' 124' ' ' ASN . 9.0 pt . . . . . 0 N--CA 1.449 -0.481 0 CA-C-O 120.81 0.338 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.447 HG21 ' HD1' ' A' ' 105' ' ' TYR . 63.9 mt -111.2 104.59 17.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.1 107.38 8.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.475 0.655 . . . . 0.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.601 ' O ' ' HA ' ' A' ' 29' ' ' SER . 28.4 mm -83.38 126.0 40.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.622 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.636 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 38.5 mt-30 -129.45 95.27 3.97 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.822 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.533 HD21 ' O ' ' A' ' 19' ' ' GLN . 1.1 mm? -129.58 159.95 34.79 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.198 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.5 mtmt -85.68 143.8 28.18 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.093 0.473 . . . . 0.0 110.453 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.479 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 23.2 p30 -80.72 -171.13 2.97 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.457 -178.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.651 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 3.3 tm? -50.51 -41.27 53.3 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.187 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.41 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 74.1 mmtt -75.73 -41.63 52.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.986 0.422 . . . . 0.0 110.977 -179.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 15.65 2.42 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.645 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.452 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 26.3 m-80 -87.92 118.05 27.2 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.8 m -64.59 107.52 1.42 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.201 0.524 . . . . 0.0 110.032 177.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.636 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 9.4 mmt180 -92.26 135.41 34.03 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.505 176.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.601 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 69.8 p -112.78 158.23 20.37 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 169.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.439 HD21 HG13 ' A' ' 38' ' ' VAL . 81.9 mt -68.1 -28.43 67.34 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.586 ' HA ' ' OD1' ' A' ' 124' ' ' ASN . 5.8 p -66.56 -17.14 64.65 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.037 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -81.85 -23.14 36.58 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.846 0.831 . . . . 0.0 109.171 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.616 HD23 HG12 ' A' ' 38' ' ' VAL . 2.4 tp -96.57 2.1 51.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.119 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -57.23 112.69 1.45 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.961 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.2 -41.97 1.12 Allowed Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.542 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 60.7 mttp -100.53 171.04 7.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.687 HG22 ' HD1' ' A' ' 69' ' ' PHE . 11.5 m -81.92 124.65 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 170.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.616 HG12 HD23 ' A' ' 33' ' ' LEU . 47.5 t -101.64 120.06 50.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.743 -170.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.594 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.5 tp -85.94 110.1 19.21 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.591 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 26.8 mm -84.38 105.12 13.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.482 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 10.3 t70 -108.52 110.65 22.2 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.68 -177.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.547 ' HB3' HD12 ' A' ' 114' ' ' LEU . 26.3 m-85 -98.23 100.31 11.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.781 174.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.467 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -136.27 -174.78 3.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.472 -176.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.619 ' CG1' ' HB3' ' A' ' 47' ' ' ASN . 12.0 p -133.18 133.03 58.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 177.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 1.004 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 42.4 m-85 -87.67 78.83 8.4 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -176.25 -38.55 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.849 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.619 ' HB3' ' CG1' ' A' ' 44' ' ' VAL . 5.0 t30 -90.07 133.24 34.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.519 -174.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.49 -22.39 32.33 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.987 -173.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.7 mtt -56.86 -30.36 63.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.868 0.366 . . . . 0.0 110.85 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.0 t -73.06 -23.03 60.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.949 -177.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.7 -58.78 5.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.797 0.332 . . . . 0.0 111.167 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.61 -31.42 68.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.26 0.552 . . . . 0.0 110.457 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.419 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.3 t60 -60.01 -41.7 92.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.726 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.587 ' HA ' HD11 ' A' ' 57' ' ' LEU . 5.2 m-20 -71.29 -20.91 62.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.795 -179.101 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.7 tt -72.47 -43.32 63.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.93 -37.35 82.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.384 0.612 . . . . 0.0 110.041 175.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.587 HD11 ' HA ' ' A' ' 54' ' ' ASN . 91.0 mt -65.19 -41.43 94.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.805 176.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -57.49 -32.06 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.84 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.68 -55.44 5.65 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.802 HD13 HD11 ' A' ' 140' ' ' ILE . 2.0 mm? -55.61 -32.41 63.08 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.757 -2.019 . . . . 0.0 111.23 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -74.47 -47.86 30.87 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.223 0.535 . . . . 0.0 109.852 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.65 -20.75 66.48 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.685 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -78.82 -60.46 2.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.989 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.509 ' HB3' HD13 ' A' ' 144' ' ' LEU . 92.3 m-85 -114.29 -5.93 12.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 113.939 1.089 . . . . 0.0 113.939 -164.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -55.36 -38.05 68.31 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.299 0.499 . . . . 0.0 111.964 -175.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.2 p -66.65 -16.38 64.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.031 -176.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.443 ' HB2' HD12 ' A' ' 144' ' ' LEU . 3.6 mm-40 -96.65 4.45 51.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.793 0.33 . . . . 0.0 110.758 -174.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.87 45.78 1.25 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.622 -176.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.687 ' HD1' HG22 ' A' ' 37' ' ' VAL . 41.9 t80 -125.96 135.34 51.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.748 0.309 . . . . 0.0 110.3 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -140.43 147.5 39.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.971 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.523 HD11 ' CE3' ' A' ' 92' ' ' TRP . 55.8 mt -107.97 129.91 61.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.044 0.45 . . . . 0.0 110.082 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.427 ' HH ' HG23 ' A' ' 95' ' ' VAL . 83.1 t80 -110.8 99.83 8.68 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.482 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 19.3 tt0 -100.59 123.3 44.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.929 -173.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.407 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 27.6 mt -110.38 127.22 67.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.302 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 1.004 ' HB3' ' HD1' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -84.97 141.52 30.29 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.177 0.298 . . . . 0.0 110.301 172.3 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.519 ' HB3' ' HA3' ' A' ' 100' ' ' GLY . 47.3 mt -96.0 -3.46 44.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 111.058 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.459 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 5.8 p-10 -90.36 -170.57 2.79 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.433 -174.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -136.47 29.18 2.81 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 173.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.33 125.88 41.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.882 0.372 . . . . 0.0 110.237 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.2 -43.87 23.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.66 -177.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.7 p80 -69.05 -42.95 75.61 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.162 -166.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -79.12 -38.23 36.63 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.278 -177.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.651 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 31.5 t90 -61.64 -51.25 69.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.06 0.457 . . . . 0.0 109.979 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.524 ' HA ' HD23 ' A' ' 23' ' ' LEU . 50.2 tttm -63.08 -52.85 61.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.219 -175.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.7 m -59.1 -35.17 72.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.995 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.473 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 24.2 t -85.17 -43.29 13.96 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.262 -178.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.579 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -80.67 -25.1 38.45 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -171.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -57.9 -31.86 67.16 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.824 0.345 . . . . 0.0 111.837 -175.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -109.29 13.98 24.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.467 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 86' ' ' SER . 17.9 mt -76.95 148.71 79.22 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.281 0.562 . . . . 0.0 111.937 -177.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.658 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -73.21 -41.5 1.26 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.648 2.899 . . . . 0.0 113.233 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.658 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.1 p90 -95.35 -171.72 2.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.837 0.351 . . . . 0.0 111.466 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.8 t -82.94 132.99 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.152 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.579 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 3.9 p -130.93 110.6 11.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -176.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.479 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 15.6 m -123.53 162.02 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.411 ' O ' HD11 ' A' ' 20' ' ' LEU . 52.4 ttp180 -124.03 129.87 51.63 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.136 -0.625 . . . . 0.0 112.271 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -106.5 111.29 23.78 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 171.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -71.22 -2.19 15.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.964 0.411 . . . . 0.0 111.318 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -103.35 10.05 37.63 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.23 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.519 ' HA3' ' HB3' ' A' ' 76' ' ' LEU . . . -64.26 76.14 0.06 OUTLIER Glycine 0 CA--C 1.522 0.521 0 N-CA-C 114.425 0.53 . . . . 0.0 114.425 -173.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 168.54 -29.74 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.649 1.18 . . . . 0.0 107.974 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -126.2 14.4 7.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.946 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.519 ' HB3' HG13 ' A' ' 106' ' ' ILE . 7.4 t -70.12 135.18 48.93 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.635 -171.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.46 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 1.4 m -54.11 -33.4 57.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.03 -177.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.481 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 29.8 m-85 -68.67 -44.45 74.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.25 -175.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.519 HG13 ' HB3' ' A' ' 103' ' ' SER . 66.3 mt -53.25 -46.34 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.837 -173.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 11.2 m -67.84 -31.12 70.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.95 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.0 mt -70.28 -26.83 63.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 0.0 110.751 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.609 ' O ' ' HB3' ' A' ' 110' ' ' ASN . 84.0 m-85 -81.8 -2.68 51.71 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.121 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.609 ' HB3' ' O ' ' A' ' 109' ' ' TYR . 3.2 t30 . . . . . 0 N--CA 1.477 0.92 0 O-C-N 124.039 0.837 . . . . 0.0 109.788 -177.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.662 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 88.6 mt . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.662 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.0 Cg_endo -70.84 156.47 95.71 Favored 'Cis proline' 0 C--N 1.362 1.249 0 CA-C-N 120.77 1.311 . . . . 0.0 114.028 1.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.403 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 69.1 m -156.88 146.38 20.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.83 178.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.475 HG13 ' HA3' ' A' ' 130' ' ' GLY . 3.3 p -103.91 156.93 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.591 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 77.0 m-85 -141.09 164.97 28.84 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.968 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 10.7 tp -111.73 138.53 48.18 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.531 -175.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.447 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 4.9 t -131.13 117.79 38.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.22 0.533 . . . . 0.0 110.005 171.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -69.15 161.39 29.21 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.635 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.542 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 25.3 mtm180 -53.94 -20.69 6.49 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -171.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . 0.53 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 56.0 t30 -83.46 5.09 25.01 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.614 ' O ' HG22 ' A' ' 15' ' ' ILE . 1.4 m120 63.64 60.68 1.07 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.664 -167.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.53 ' HG3' ' HB3' ' A' ' 123' ' ' ASN . 56.3 mt-10 -126.2 118.15 24.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.352 179.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.518 ' H ' HG23 ' A' ' 15' ' ' ILE . 0.9 OUTLIER -57.58 109.04 0.63 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.392 0.615 . . . . 0.0 109.36 176.368 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.968 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -82.43 -48.59 10.92 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.486 -172.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -175.7 172.93 2.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.286 -178.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.556 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 78.7 mtt85 -90.89 156.65 17.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.074 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.475 ' HA3' HG13 ' A' ' 117' ' ' VAL . . . -59.33 -38.58 93.55 Favored Glycine 0 C--O 1.228 -0.221 0 C-N-CA 121.521 -0.371 . . . . 0.0 112.567 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.556 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.2 OUTLIER -79.46 -19.21 50.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.46 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.53 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -86.59 -19.58 29.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.511 0.672 . . . . 0.0 109.498 179.871 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 129' ' ' ARG . 83.2 mt -92.28 123.27 44.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.562 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -57.12 -45.09 83.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.692 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.604 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 2.4 p-10 -156.61 128.66 7.36 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.567 ' O ' HG13 ' A' ' 140' ' ' ILE . 6.8 mp -75.31 -25.87 58.21 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.594 -174.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.511 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.0 t70 -50.74 -58.38 6.05 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 123.475 0.485 . . . . 0.0 109.931 174.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.604 ' HB2' ' OD2' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -55.96 -41.69 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.12 175.888 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.32 -52.61 52.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.82 -175.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.802 HD11 HD13 ' A' ' 60' ' ' LEU . 45.8 mt -59.96 -42.34 89.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.61 0.719 . . . . 0.0 109.878 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.536 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.9 ttpt -57.58 -40.03 78.1 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.331 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -84.67 -24.67 28.9 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.945 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 30.8 mt -66.45 -40.72 89.59 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-O 120.958 0.409 . . . . 0.0 110.164 175.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.509 HD13 ' HB3' ' A' ' 64' ' ' TYR . 95.9 mt . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.948 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 tp . . . . . 0 N--CA 1.448 -0.569 0 CA-C-O 121.591 0.71 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.698 HD13 ' H ' ' A' ' 16' ' ' ILE . 0.2 OUTLIER -90.18 136.26 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.582 177.881 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -104.7 107.61 18.65 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.597 ' O ' ' HA ' ' A' ' 29' ' ' SER . 33.8 mt -92.47 110.53 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.252 -175.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -108.63 100.64 9.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.131 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.714 ' HB2' HG12 ' A' ' 95' ' ' VAL . 39.1 mt -139.33 166.4 24.64 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.665 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 34.2 mttm -96.5 150.26 20.82 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 121.129 0.49 . . . . 0.0 110.988 177.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.551 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.4 OUTLIER -82.55 -171.88 3.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.192 179.104 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 1.06 HD11 ' HA ' ' A' ' 88' ' ' ASP . 1.0 OUTLIER -49.28 -44.74 44.24 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.807 177.991 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -79.83 -20.41 46.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.011 -176.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.61 7.92 27.19 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.059 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -82.58 113.31 20.21 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.965 0.412 . . . . 0.0 110.377 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.665 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 24.9 m -69.76 119.86 14.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.528 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 14.8 mmm180 -110.27 138.67 46.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.773 177.049 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.597 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 12.0 p -119.39 164.27 15.97 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 174.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.542 HD21 HG13 ' A' ' 38' ' ' VAL . 33.5 mt -80.3 -34.03 37.14 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.415 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.5 p -65.05 -16.78 63.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.226 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -78.2 -37.49 45.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.865 0.841 . . . . 0.0 109.082 177.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.484 HD21 HG12 ' A' ' 38' ' ' VAL . 3.7 tp -81.44 5.65 16.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.487 -1.233 . . . . 0.0 111.427 -173.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -62.83 114.73 3.81 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.126 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.71 -39.74 1.0 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 -174.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.633 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 84.6 mttt -104.15 170.89 7.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 172.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.79 HG23 ' HD1' ' A' ' 69' ' ' PHE . 15.8 m -83.57 125.95 40.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 168.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.542 HG13 HD21 ' A' ' 30' ' ' LEU . 59.8 t -101.64 123.74 54.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.312 0.577 . . . . 0.0 111.664 -168.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.404 HD23 ' HZ ' ' A' ' 69' ' ' PHE . 12.4 tp -89.25 121.27 31.38 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.113 172.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.552 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -97.91 105.13 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.457 177.812 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.565 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 12.7 t70 -102.36 128.68 48.83 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.411 -177.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.593 ' HZ ' ' HH ' ' A' ' 109' ' ' TYR . 77.2 m-85 -121.77 97.7 5.61 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 176.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.789 ' O ' ' HA ' ' A' ' 75' ' ' SER . 31.1 m -138.66 147.41 42.81 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.758 -170.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.571 HG13 ' HG ' ' A' ' 76' ' ' LEU . 29.7 m -96.04 119.54 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 121.315 0.578 . . . . 0.0 109.998 173.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.527 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 5.5 m-85 -73.01 85.34 1.29 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.97 177.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 t30 173.94 -36.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.638 -172.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -74.04 150.87 40.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.613 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.89 -29.67 68.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -173.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.3 mtt -66.75 -20.48 65.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.601 0.239 . . . . 0.0 110.504 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.1 t -58.67 -29.17 66.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.109 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.63 -55.2 21.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.89 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.66 -30.86 64.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.518 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 82.5 t60 -69.49 -37.53 77.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -63.29 -38.62 91.88 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.282 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.13 -52.02 65.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.15 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.53 90.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.137 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 89.7 mt -62.9 -42.07 99.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.2 0.524 . . . . 0.0 109.912 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.84 -31.75 71.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.919 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.435 ' HG2' ' HE3' ' A' ' 63' ' ' LYS . 7.7 tt0 -75.94 -56.15 4.94 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 -172.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.815 HD13 HD11 ' A' ' 140' ' ' ILE . 2.1 mm? -54.69 -32.2 59.08 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.417 -2.174 . . . . 0.0 111.289 178.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -77.96 -50.62 11.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.139 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.411 HD21 ' N ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -65.14 -21.78 66.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.045 0.45 . . . . 0.0 110.865 -176.871 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.435 ' HE3' ' HG2' ' A' ' 59' ' ' GLU . 89.8 mttt -77.3 -55.08 5.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.113 177.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.561 ' HB3' HD13 ' A' ' 144' ' ' LEU . 94.0 m-85 -113.79 -9.26 13.14 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -164.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.535 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -54.56 -43.34 71.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.2 m -67.77 -18.62 64.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.824 -175.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.413 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 0.9 OUTLIER -95.45 4.8 52.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.811 -179.108 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.59 51.57 0.7 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.637 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.79 ' HD1' HG23 ' A' ' 37' ' ' VAL . 56.6 t80 -127.85 143.07 51.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.615 0.245 . . . . 0.0 110.386 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.633 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.38 147.63 38.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.134 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.449 HD11 ' CE3' ' A' ' 92' ' ' TRP . 68.3 mt -112.96 117.77 56.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.156 0.503 . . . . 0.0 110.09 175.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.479 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 81.0 t80 -100.74 99.93 10.54 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 175.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.565 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 12.0 tm0? -91.12 143.37 26.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.828 -173.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 65.5 mt -136.86 121.61 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.789 ' HA ' ' O ' ' A' ' 43' ' ' THR . 89.3 p -99.99 121.13 40.88 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 121.524 0.678 . . . . 0.0 110.973 177.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.581 HD11 HD12 ' A' ' 106' ' ' ILE . 0.6 OUTLIER -101.56 43.29 1.07 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.123 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -77.48 -169.76 1.55 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.326 -1.306 . . . . 0.0 111.648 -174.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -129.18 21.39 5.2 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.603 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.414 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 28.0 t70 -162.64 115.14 1.63 Allowed 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.304 0.573 . . . . 0.0 110.236 -177.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.527 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 18.1 tt0 -77.35 -14.33 59.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.157 -176.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . 0.414 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 56.3 m80 -68.68 -56.85 6.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.793 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -60.61 -47.86 84.35 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 120.859 0.362 . . . . 0.0 110.067 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.527 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 39.5 t90 -55.51 -52.45 63.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.506 179.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.527 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 24.9 ttmt -65.8 -47.77 73.98 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.421 -174.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.8 p -62.98 -34.96 78.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.03 0.443 . . . . 0.0 111.317 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.1 m -78.43 -48.5 15.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.452 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.604 ' HB1' HD23 ' A' ' 23' ' ' LEU . . . -88.79 -21.05 23.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -168.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 1.06 ' HA ' HD11 ' A' ' 23' ' ' LEU . 28.2 t70 -57.93 -31.12 66.51 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -168.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -101.58 16.22 26.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.34 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.53 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 25.9 mt -81.25 157.65 70.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.09 0.472 . . . . 0.0 111.745 -178.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.588 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 56.1 Cg_endo -64.24 -52.15 1.72 Allowed 'Trans proline' 0 N--CA 1.477 0.536 0 C-N-CA 124.148 3.232 . . . . 0.0 113.575 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.588 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 13.1 p90 -89.55 179.02 6.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.227 0.537 . . . . 0.0 111.668 -173.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.528 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 48.4 t -76.48 123.68 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.102 -176.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.781 ' HB2' HD12 ' A' ' 23' ' ' LEU . 62.5 m -116.98 109.08 16.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.126 0.488 . . . . 0.0 110.131 -178.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.714 HG12 ' HB2' ' A' ' 20' ' ' LEU . 11.1 t -114.73 159.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.304 -172.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.51 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 31.3 ttt180 -122.02 142.15 50.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.737 0.303 . . . . 0.0 110.579 179.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -83.6 142.72 30.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.19 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.38 -5.58 58.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -172.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.468 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 12.7 m120 -119.95 -13.73 9.0 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.051 -0.66 . . . . 0.0 112.568 -175.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.424 ' C ' ' H ' ' A' ' 102' ' ' TYR . . . 57.24 82.71 0.05 OUTLIER Glycine 0 CA--C 1.522 0.525 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.339 174.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.502 ' H ' ' HB2' ' A' ' 76' ' ' LEU . . . 74.35 -29.06 0.19 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.436 0.694 . . . . 0.0 111.556 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.424 ' H ' ' C ' ' A' ' 100' ' ' GLY . 87.9 m-85 -85.38 21.57 1.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.548 ' HB3' HG13 ' A' ' 106' ' ' ILE . 38.3 t -61.56 144.51 54.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.811 -173.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.543 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 15.9 m -72.75 -29.89 63.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.741 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -68.71 -40.7 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.445 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.581 HD12 HD11 ' A' ' 76' ' ' LEU . 74.2 mt -55.49 -34.3 34.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.834 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.5 m -80.44 -27.14 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.0 mt -68.55 -42.09 78.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.268 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.593 ' HH ' ' HZ ' ' A' ' 42' ' ' PHE . 37.2 m-85 -80.58 -20.4 43.43 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.501 178.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.548 ' C ' HD21 ' A' ' 110' ' ' ASN . 0.2 OUTLIER . . . . . 0 CA--C 1.514 -0.435 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -169.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.447 ' HG ' ' CD1' ' A' ' 76' ' ' LEU . 3.9 mm? . . . . . 0 C--O 1.234 0.268 0 N-CA-C 110.651 -0.129 . . . . 0.0 110.651 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.497 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 12.5 Cg_exo -73.42 156.02 99.65 Favored 'Cis proline' 0 C--N 1.349 0.57 0 C-N-CA 123.69 -1.379 . . . . 0.0 112.418 -0.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.5 m -140.26 170.08 16.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.286 -177.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.35 155.75 16.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.836 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.577 ' HE2' ' HD2' ' A' ' 129' ' ' ARG . 90.2 m-85 -138.1 157.73 45.75 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.678 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -111.46 141.85 44.49 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -177.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.516 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 6.8 t -138.7 129.4 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 174.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.633 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 4.6 p30 -85.45 170.61 12.51 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.063 178.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.51 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 13.4 ptt180 -52.72 -23.2 6.26 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -170.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -81.61 3.29 25.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.733 0.302 . . . . 0.0 110.24 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 65.93 53.28 1.13 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.598 -171.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.633 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 41.3 mt-10 -124.73 137.66 54.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.916 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 4.2 tt -68.18 109.31 3.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.318 0.58 . . . . 0.0 109.606 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.678 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 23.4 m -71.55 -57.84 4.04 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.237 -177.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.01 171.83 15.93 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.78 -175.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.577 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -98.75 146.06 26.29 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.783 -178.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -50.39 -26.69 10.09 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 121.528 -0.367 . . . . 0.0 113.041 178.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.77 -44.06 94.53 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.978 0.511 . . . . 0.0 111.592 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -104.51 -6.63 20.44 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -170.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.797 HG23 ' HG ' ' A' ' 136' ' ' LEU . 80.2 mt -76.57 100.44 2.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.193 0.52 . . . . 0.0 109.855 175.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.55 -50.07 75.0 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.044 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -139.59 109.07 6.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.978 -177.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.797 ' HG ' HG23 ' A' ' 133' ' ' ILE . 5.7 mp -70.46 -37.4 74.29 Favored 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.424 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.465 ' HA ' HD12 ' A' ' 60' ' ' LEU . 9.6 t70 -53.2 -52.33 59.21 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.591 177.051 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -64.16 -41.55 97.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.276 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.67 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -62.99 -50.73 69.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.853 -176.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.815 HD11 HD13 ' A' ' 60' ' ' LEU . 43.1 mt -61.15 -37.03 76.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.377 0.608 . . . . 0.0 110.272 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -61.94 -41.23 97.73 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.278 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.67 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -81.4 -19.51 42.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 111.193 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 75.4 mt -74.29 -39.54 62.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.809 176.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.561 HD13 ' HB3' ' A' ' 64' ' ' TYR . 65.4 mt . . . . . 0 C--N 1.326 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.423 -177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.935 HG21 ' H ' ' A' ' 126' ' ' LEU . 34.5 pt . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.444 ' N ' HD12 ' A' ' 16' ' ' ILE . 4.0 mp -86.41 89.71 2.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.86 115.43 9.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.694 174.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.55 HD12 ' HH ' ' A' ' 109' ' ' TYR . 7.0 mt -104.26 122.11 56.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.837 -177.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.63 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 2.2 mp0 -112.71 100.5 8.75 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.198 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.417 ' HG ' HG23 ' A' ' 18' ' ' ILE . 71.1 mt -132.81 156.19 47.58 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.618 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 97.1 mttt -82.3 138.02 34.67 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.886 0.374 . . . . 0.0 111.465 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.575 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -88.96 -167.66 1.95 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.87 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.581 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 55.4 tp -50.39 -36.86 34.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.77 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -77.74 -10.09 59.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.967 0.413 . . . . 0.0 111.805 -178.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.77 18.17 60.37 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.473 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.9 OUTLIER -100.55 123.57 44.94 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.226 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.618 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 4.7 m -64.48 115.63 5.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.468 0.651 . . . . 0.0 111.367 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.63 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.6 mmm180 -88.06 142.67 27.59 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.851 172.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.616 ' CB ' ' HG3' ' A' ' 19' ' ' GLN . 1.5 m -124.01 138.56 54.44 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.518 HD21 HG12 ' A' ' 38' ' ' VAL . 50.5 mt -63.82 -32.92 74.59 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.026 178.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.8 0.05 14.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.258 177.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -105.27 -41.95 5.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.531 0.682 . . . . 0.0 109.339 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.456 ' CD1' HG21 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -78.83 -0.16 29.48 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.427 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.518 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 24.6 ttpp -63.09 102.87 0.41 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.714 176.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.86 -30.49 0.21 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -175.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -113.63 174.2 6.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 167.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.434 HG23 ' HD1' ' A' ' 69' ' ' PHE . 21.3 m -80.93 129.26 37.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.635 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 47.6 t -101.0 116.3 44.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.193 0.52 . . . . 0.0 110.812 -171.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.562 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 14.1 tp -82.84 111.75 19.03 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.596 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 27.4 mm -83.98 105.29 13.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.579 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 16.2 t70 -108.62 130.08 55.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.791 -178.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.563 ' HB3' HD22 ' A' ' 114' ' ' LEU . 51.5 m-85 -117.69 116.25 26.68 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 173.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.549 ' O ' ' HA ' ' A' ' 75' ' ' SER . 14.7 t -149.36 -176.44 5.38 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 -178.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.613 HG12 ' HB2' ' A' ' 47' ' ' ASN . 1.7 p -131.95 117.89 35.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 176.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.546 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 28.2 m-85 -77.42 79.33 3.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 122.173 0.987 . . . . 0.0 109.329 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.504 ' HB3' HG23 ' A' ' 44' ' ' VAL . 21.3 t-20 178.1 -27.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.208 -1.815 . . . . 0.0 109.297 -177.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.613 ' HB2' HG12 ' A' ' 44' ' ' VAL . 25.3 t-20 -86.16 141.09 29.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.72 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -25.8 66.6 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.163 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 94.5 mmm -68.43 -17.41 64.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.528 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.8 t -71.99 -28.48 63.44 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.64 -55.14 38.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.23 -26.39 63.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.245 0.545 . . . . 0.0 110.831 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.423 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.6 t60 -70.21 -45.52 66.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.524 -179.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.574 ' HA ' HD12 ' A' ' 57' ' ' LEU . 8.0 m120 -64.31 -28.05 69.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.986 178.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -62.8 -55.09 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.609 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.37 74.82 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.574 HD12 ' HA ' ' A' ' 54' ' ' ASN . 90.2 mt -63.56 -41.09 98.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.067 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -61.95 -30.32 70.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.092 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.32 -51.86 12.2 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -174.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.818 HD13 HD13 ' A' ' 140' ' ' ILE . 2.4 mm? -58.05 -29.99 65.8 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 112.673 -2.058 . . . . 0.0 111.299 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -78.68 -50.35 11.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.028 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -60.6 -21.95 63.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.202 0.525 . . . . 0.0 110.613 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -79.56 -57.1 3.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.412 177.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.563 ' HH ' ' CG ' ' A' ' 137' ' ' ASP . 91.3 m-85 -112.64 -8.65 13.79 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -165.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.554 ' C ' ' H ' ' A' ' 67' ' ' GLN . . . -68.99 169.83 11.0 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.115 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.3 m 70.06 -35.04 0.3 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.744 0.652 . . . . 0.0 110.799 -174.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.554 ' H ' ' C ' ' A' ' 65' ' ' ALA . 23.1 mt-30 -82.25 16.88 1.83 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.716 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.96 18.04 14.86 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.994 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.562 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 66.8 t80 -107.61 144.49 34.57 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.544 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 8.7 tp10 -145.06 156.09 43.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.463 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.528 HD12 ' CE3' ' A' ' 92' ' ' TRP . 48.3 mt -120.26 129.49 75.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.062 0.458 . . . . 0.0 110.001 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.458 ' HH ' HG23 ' A' ' 95' ' ' VAL . 78.5 t80 -117.8 101.01 7.96 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.405 178.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.579 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 39.2 mt-30 -92.74 144.15 25.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.473 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.5 mt -123.66 116.4 48.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.329 172.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.549 ' HA ' ' O ' ' A' ' 43' ' ' THR . 62.7 p -92.11 134.51 34.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.377 . . . . 0.0 110.993 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.598 HD13 HD23 ' A' ' 114' ' ' LEU . 50.2 mt -104.65 37.35 2.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.311 0.577 . . . . 0.0 109.623 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.52 ' HA ' HG21 ' A' ' 44' ' ' VAL . 3.5 p30 -87.38 172.05 10.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.861 -173.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -125.85 34.36 3.3 Favored Glycine 0 N--CA 1.442 -0.925 0 N-CA-C 110.056 -1.217 . . . . 0.0 110.056 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -149.55 101.92 3.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.17 0.51 . . . . 0.0 109.906 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -76.57 -25.71 54.3 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.654 -174.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -74.34 -30.38 62.0 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.234 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -76.14 -47.62 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.865 174.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.581 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 59.3 t90 -56.37 -42.02 77.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.632 176.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.529 ' HA ' ' CD1' ' A' ' 23' ' ' LEU . 22.5 ttmm -67.14 -51.78 49.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.315 -179.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 m -69.36 -22.0 63.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 0.0 111.402 -175.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.481 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 22.8 t -85.08 -35.12 22.04 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.262 . . . . 0.0 110.682 178.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.531 ' HA ' HD13 ' A' ' 90' ' ' LEU . . . -79.5 -17.93 53.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.658 -176.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -50.15 -45.74 53.45 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.53 0.519 . . . . 0.0 112.116 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -100.07 14.86 29.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.331 -176.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.531 HD13 ' HA ' ' A' ' 87' ' ' ALA . 22.5 mt -88.09 144.73 34.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.38 0.609 . . . . 0.0 111.923 -176.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.651 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 59.7 Cg_endo -80.89 -38.9 0.24 Allowed 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.828 3.019 . . . . 0.0 113.687 -176.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.651 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.2 p90 -101.17 -169.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.166 -171.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.504 HG11 ' HG3' ' A' ' 28' ' ' ARG . 46.7 t -91.93 131.42 39.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.791 0.329 . . . . 0.0 110.689 -172.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 85.4 m -130.31 114.91 16.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.284 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.575 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.4 m -115.97 165.74 10.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -121.92 144.51 48.82 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.349 -179.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -89.17 157.21 18.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.35 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.1 -33.39 29.77 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -174.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.569 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 53.7 t30 -118.13 -12.21 10.05 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.499 -171.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.9 -128.26 8.5 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.657 175.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.5 4.01 5.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.569 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 20.7 m-85 -111.69 13.02 21.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.97 0.414 . . . . 0.0 109.949 178.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.2 t -64.74 137.43 57.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.443 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 14.8 m -64.36 -24.24 67.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.018 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -61.08 -46.13 91.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.958 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.9 mt -61.54 -31.23 50.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.075 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 14.3 m -71.18 -23.05 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.349 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.33 -17.27 46.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.55 ' HH ' HD12 ' A' ' 18' ' ' ILE . 90.4 m-85 -89.49 -20.59 23.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.198 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 C--N 1.331 -0.239 0 CA-C-O 122.204 1.002 . . . . 0.0 108.708 -167.313 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.598 HD23 HD13 ' A' ' 76' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.485 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 27.4 Cg_endo -62.94 153.28 69.31 Favored 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.296 -1.127 . . . . 0.0 113.621 0.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.4 m -137.33 170.67 15.69 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.271 -177.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.5 p -142.44 153.69 18.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.596 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 64.1 m-85 -140.85 164.8 29.25 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 1.011 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 9.9 tp -110.7 134.5 52.4 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.635 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 10.3 t -125.93 117.25 48.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.421 0.629 . . . . 0.0 110.532 171.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.512 ' HA ' HD11 ' A' ' 143' ' ' LEU . 18.4 t30 -68.9 161.76 28.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.283 177.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -17.66 10.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -169.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -90.95 14.79 12.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.005 0.431 . . . . 0.0 110.17 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.518 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 1.0 OUTLIER 59.0 58.96 2.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.025 -175.182 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.444 ' HA ' HG21 ' A' ' 15' ' ' ILE . 32.5 mt-10 -124.22 123.77 40.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.054 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.935 ' H ' HG21 ' A' ' 15' ' ' ILE . 19.6 mt -56.52 107.21 0.36 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.417 0.627 . . . . 0.0 110.016 172.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 1.011 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 49.5 m -79.7 -42.47 24.6 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.681 -175.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 179.96 172.74 1.01 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.392 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.508 ' O ' HG13 ' A' ' 133' ' ' ILE . 86.7 mtm180 -103.59 159.25 15.76 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.909 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -47.23 -43.83 19.43 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 114.327 0.491 . . . . 0.0 114.327 -174.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -72.55 -29.68 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.095 0.474 . . . . 0.0 111.379 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.424 ' OD1' ' HB2' ' A' ' 129' ' ' ARG . 8.9 m120 -79.54 -26.44 41.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.829 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.851 HG21 ' HG ' ' A' ' 136' ' ' LEU . 78.3 mt -82.01 112.3 19.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.877 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.441 ' N ' ' HD2' ' A' ' 134' ' ' LYS . 3.3 mptp? -90.44 98.11 11.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.984 174.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.93 106.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.131 -176.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.851 ' HG ' HG21 ' A' ' 133' ' ' ILE . 6.0 mp -70.07 -25.37 63.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.518 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.563 ' CG ' ' HH ' ' A' ' 64' ' ' TYR . 10.0 t70 -50.59 -52.64 37.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.375 177.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.52 -44.14 95.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.046 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.414 ' HB2' HD23 ' A' ' 119' ' ' LEU . . . -57.83 -53.88 53.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.698 -176.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.818 HD13 HD13 ' A' ' 60' ' ' LEU . 42.4 mt -60.37 -39.96 82.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.007 0.432 . . . . 0.0 111.115 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.619 ' HZ2' ' HB2' ' A' ' 141' ' ' LYS . 3.9 ttmp? -58.5 -44.36 89.39 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.744 -178.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -78.94 -24.45 43.96 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.769 -176.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.512 HD11 ' HA ' ' A' ' 121' ' ' ASN . 27.5 mt -72.18 -38.14 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.24 0.543 . . . . 0.0 110.372 175.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.537 HD12 ' HB3' ' A' ' 64' ' ' TYR . 28.6 mt . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.001 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.722 HG22 ' O ' ' A' ' 124' ' ' ASN . 6.9 tt . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.491 ' O ' HD11 ' A' ' 30' ' ' LEU . 3.9 mp -97.26 138.01 23.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -92.64 108.48 20.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.545 HD12 ' OH ' ' A' ' 109' ' ' TYR . 8.9 mt -89.47 115.4 29.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.352 -177.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -111.91 100.16 8.68 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.517 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.664 ' HB2' HG12 ' A' ' 95' ' ' VAL . 22.2 mt -136.08 162.42 32.96 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.611 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.1 mttm -90.83 147.47 23.16 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.67 0.747 . . . . 0.0 111.17 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.565 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.7 OUTLIER -84.27 -173.51 4.76 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.625 -174.036 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.843 HD11 ' HA ' ' A' ' 84' ' ' LYS . 15.0 tp -54.29 -42.73 70.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.616 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.512 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.02 -39.92 83.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.601 178.314 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.469 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 124.12 13.91 3.87 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.172 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.8 m-80 -96.7 125.44 41.16 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 122.818 -0.225 . . . . 0.0 110.536 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.611 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 7.8 m -63.33 113.6 3.32 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.407 0.622 . . . . 0.0 110.586 177.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.475 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 9.4 mmm180 -102.16 127.97 48.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.246 177.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 57.6 p -115.67 158.42 22.77 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 174.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.747 ' HB3' HD22 ' A' ' 124' ' ' ASN . 79.0 mt -74.07 -29.12 61.72 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.4 p -63.37 -22.6 66.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.569 175.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -91.13 -34.42 15.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.602 0.715 . . . . 0.0 109.724 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.649 HD13 ' HG2' ' A' ' 70' ' ' GLU . 11.9 tp -82.01 10.04 7.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.857 -177.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -64.18 -11.17 28.25 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.591 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.36 -18.46 65.38 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.1 -178.31 4.77 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.891 0.377 . . . . 0.0 110.266 177.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.676 HG23 ' HD1' ' A' ' 69' ' ' PHE . 16.6 m -85.36 126.83 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 168.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.509 HG13 HD21 ' A' ' 30' ' ' LEU . 38.7 t -101.04 129.18 52.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.27 0.557 . . . . 0.0 111.663 -167.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.743 HD11 HD22 ' A' ' 136' ' ' LEU . 12.4 tp -95.72 110.58 22.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.512 173.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.536 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.0 mm -84.77 105.78 14.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.508 ' HB3' ' NE2' ' A' ' 73' ' ' GLN . 5.6 t70 -114.04 129.82 56.59 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.898 -175.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -116.58 97.78 6.19 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.742 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 m -137.95 141.45 40.54 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.212 0.53 . . . . 0.0 111.518 -170.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.623 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.1 OUTLIER -95.63 118.22 41.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.018 -177.799 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -77.26 80.74 3.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.662 0.744 . . . . 0.0 109.708 174.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.466 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 19.7 t-20 174.35 -33.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.855 -176.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.623 ' HB2' HG13 ' A' ' 44' ' ' VAL . 8.0 t-20 -73.4 148.85 42.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.031 -176.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.43 -33.54 71.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.807 -178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.1 tpp -67.58 -26.79 66.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.061 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.7 m -60.99 -32.97 72.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.997 -175.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.69 95.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.842 0.353 . . . . 0.0 111.191 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.66 -29.49 45.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.098 0.475 . . . . 0.0 110.572 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.435 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 85.5 t60 -65.85 -42.41 90.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.819 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -66.23 -21.44 66.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.591 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.2 tm? -64.14 -54.92 26.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.416 0.627 . . . . 0.0 109.91 176.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.18 -33.11 72.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.8 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 86.8 mt -65.15 -40.45 94.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.804 176.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.1 tpt180 -59.28 -33.51 71.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.778 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.81 -55.1 6.18 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -172.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.781 HD11 HD11 ' A' ' 140' ' ' ILE . 2.0 mm? -55.2 -31.91 61.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 112.846 -1.979 . . . . 0.0 111.624 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.401 ' HD1' HG13 ' A' ' 71' ' ' ILE . 24.9 t80 -77.97 -48.8 15.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.978 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.403 ' N ' HD21 ' A' ' 62' ' ' ASN . 1.0 OUTLIER -63.79 -21.68 66.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.548 -177.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -77.36 -58.62 3.17 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.91 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.593 ' CE1' ' HG3' ' A' ' 141' ' ' LYS . 96.2 m-85 -109.14 -10.65 14.98 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -165.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.475 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -53.65 -37.87 63.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.219 0.463 . . . . 0.0 111.849 -176.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.4 m -67.64 -15.21 63.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -107.99 9.61 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 0.0 111.054 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.433 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 104.88 48.97 1.04 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.912 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.676 ' HD1' HG23 ' A' ' 37' ' ' VAL . 72.4 t80 -121.92 138.77 54.28 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.649 ' HG2' HD13 ' A' ' 33' ' ' LEU . 8.7 tp10 -138.69 146.03 41.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.287 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.416 HD11 ' CE3' ' A' ' 92' ' ' TRP . 72.2 mt -112.41 124.64 69.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.927 0.394 . . . . 0.0 110.239 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.593 ' CE1' HG22 ' A' ' 95' ' ' VAL . 89.9 t80 -104.5 100.0 9.68 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.79 ' HA ' HE21 ' A' ' 73' ' ' GLN . 0.0 OUTLIER -83.49 136.67 34.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.861 -177.691 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -125.78 108.32 19.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.742 ' HA ' ' O ' ' A' ' 43' ' ' THR . 66.5 p -83.11 126.3 32.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.309 0.576 . . . . 0.0 111.189 -175.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.444 HD21 ' H ' ' A' ' 101' ' ' ALA . 17.3 mt -102.94 39.36 1.56 Allowed 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.561 ' HA ' HG21 ' A' ' 44' ' ' VAL . 1.8 p-10 -61.42 -71.91 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.266 -170.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.41 12.25 42.3 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -170.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -163.1 100.47 0.97 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.9 -26.37 61.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.008 -171.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -74.02 -29.1 61.76 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.694 -0.803 . . . . 0.0 110.89 -174.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -71.68 -48.9 44.38 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.59 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 27.9 t90 -60.67 -47.19 87.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.293 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.843 ' HA ' HD11 ' A' ' 23' ' ' LEU . 12.2 ttmt -62.35 -45.33 93.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.639 0.257 . . . . 0.0 111.497 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -68.12 -31.23 70.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.461 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.4 p -85.58 -33.67 21.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.897 0.38 . . . . 0.0 111.651 -177.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.563 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -86.32 -18.92 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.603 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 15.1 t70 -64.12 -27.05 68.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.899 0.381 . . . . 0.0 111.789 -173.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -97.0 8.23 44.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.282 0.563 . . . . 0.0 110.419 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 87' ' ' ALA . 38.3 mt -86.89 152.21 53.32 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.179 0.514 . . . . 0.0 111.726 -177.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.557 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -72.53 -58.67 0.07 OUTLIER 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.691 2.928 . . . . 0.0 114.046 -176.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.557 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.9 p90 -83.35 -173.79 4.91 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.98 124.63 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.617 ' HA ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 m -117.94 109.47 16.54 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.664 HG12 ' HB2' ' A' ' 20' ' ' LEU . 11.3 t -115.99 156.56 17.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.814 -176.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.419 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 14.8 ttp180 -113.21 139.62 48.63 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.487 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.67 156.99 20.44 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.955 0.407 . . . . 0.0 110.065 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.417 ' C ' HD21 ' A' ' 99' ' ' ASN . . . -82.04 -29.17 32.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -175.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.417 HD21 ' C ' ' A' ' 98' ' ' ALA . 0.9 OUTLIER -114.26 -14.1 12.3 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -171.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.56 78.03 0.3 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.486 178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.444 ' H ' HD21 ' A' ' 76' ' ' LEU . . . 80.42 -31.53 0.12 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.878 0.871 . . . . 0.0 111.897 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -85.01 37.34 0.66 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.344 0.593 . . . . 0.0 110.016 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.552 ' HB3' HG13 ' A' ' 106' ' ' ILE . 22.8 t -89.7 141.95 28.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.126 -172.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.426 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 2.9 p -61.28 -38.22 85.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.178 178.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -55.35 -44.48 75.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.377 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.552 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.5 mt -64.27 -28.94 46.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.011 -176.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 27.9 m -77.8 -24.76 48.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.582 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.9 mt -71.18 -37.23 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.993 -179.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.545 ' OH ' HD12 ' A' ' 18' ' ' ILE . 93.3 m-85 -69.87 -23.14 63.22 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.292 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 . . . . . 0 C--N 1.327 -0.378 0 CA-C-O 122.384 1.088 . . . . 0.0 108.801 -167.327 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.638 HD12 ' OG ' ' A' ' 116' ' ' SER . 3.0 mm? . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.449 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 24.1 Cg_exo -65.26 152.52 77.46 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 124.474 -1.052 . . . . 0.0 112.655 0.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.638 ' OG ' HD12 ' A' ' 114' ' ' LEU . 13.0 m -127.55 166.12 18.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.036 -175.05 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' A' ' 40' ' ' ILE . 7.9 p -143.28 154.56 16.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.536 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 84.4 m-85 -139.02 163.74 31.6 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 176.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.852 HD11 HD13 ' A' ' 136' ' ' LEU . 14.7 tp -110.53 135.43 51.2 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.508 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 44.9 t -133.62 125.08 49.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.754 0.312 . . . . 0.0 110.484 176.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.55 ' HB3' HD21 ' A' ' 143' ' ' LEU . 8.9 p30 -82.9 166.75 18.65 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -75.31 18.62 0.2 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -169.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . 0.447 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 63.4 t30 -95.22 -0.86 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 166.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.747 HD22 ' HB3' ' A' ' 30' ' ' LEU . 2.4 t-20 59.78 67.21 0.9 Allowed 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.561 -165.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.1 mm-40 -137.83 141.76 40.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.326 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 47.8 mt -68.88 130.79 43.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.536 0.684 . . . . 0.0 110.729 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.827 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 73.2 m -101.63 -49.87 3.88 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.942 -177.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -164.86 164.5 20.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.859 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.418 ' O ' HG13 ' A' ' 133' ' ' ILE . 92.8 mtt180 -96.96 162.24 13.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.21 -36.37 92.3 Favored Glycine 0 C--O 1.226 -0.374 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.242 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -76.46 -1.87 29.28 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 0.0 110.736 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -112.49 -18.13 12.49 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 110.539 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.654 HG22 HD12 ' A' ' 136' ' ' LEU . 96.7 mt -88.82 110.13 20.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.3 0.572 . . . . 0.0 111.247 -175.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.654 ' HG3' ' H ' ' A' ' 135' ' ' ASP . 11.2 ptmm? -72.94 -60.07 2.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 174.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.654 ' H ' ' HG3' ' A' ' 134' ' ' LYS . 7.2 m-20 -128.06 116.67 20.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.852 HD13 HD11 ' A' ' 119' ' ' LEU . 2.9 tp -75.28 -27.25 59.31 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.293 0.568 . . . . 0.0 109.553 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -52.55 -56.29 16.28 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.608 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.465 ' CD ' ' HZ1' ' A' ' 134' ' ' LYS . 12.1 pt-20 -62.46 -48.65 78.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.033 0.444 . . . . 0.0 111.33 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.401 ' N ' ' HG3' ' A' ' 138' ' ' GLU . . . -55.95 -54.25 46.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.286 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.799 HD13 ' HG ' ' A' ' 136' ' ' LEU . 27.0 mt -63.5 -29.68 47.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.727 0.299 . . . . 0.0 111.247 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.593 ' HG3' ' CE1' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -61.8 -43.81 98.11 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 110.018 177.508 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 142' ' ' LYS . 59.5 mmtt -75.27 -19.2 59.84 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.014 -178.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' A' ' 121' ' ' ASN . 40.2 mt -71.82 -40.25 69.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.289 0.566 . . . . 0.0 110.506 175.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.474 HD13 ' HB3' ' A' ' 64' ' ' TYR . 95.4 mt . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.56 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.574 HG23 ' O ' ' A' ' 124' ' ' ASN . 13.5 tt . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 121.264 0.554 . . . . 0.0 111.762 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.434 HD11 ' N ' ' A' ' 16' ' ' ILE . 4.4 mp -99.31 130.65 47.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.486 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -75.85 107.51 8.08 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.526 HD11 ' OH ' ' A' ' 109' ' ' TYR . 9.2 mt -89.02 105.37 15.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.686 -172.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.662 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 76.8 mt-30 -100.12 99.95 10.73 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.522 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.8 mt -136.82 153.11 50.89 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 176.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.642 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 90.8 mttt -87.87 136.23 33.05 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.907 0.86 . . . . 0.0 112.103 -173.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.409 ' HA ' HG11 ' A' ' 95' ' ' VAL . 12.5 t70 -61.08 165.85 3.99 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.5 -1.682 . . . . 0.0 108.952 172.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.521 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER -59.43 -30.05 68.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.642 0.734 . . . . 0.0 110.143 179.083 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.501 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 36.3 mtmm -69.05 -8.54 46.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.13 176.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.39 8.06 61.49 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.406 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -97.23 111.98 23.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.7 0.286 . . . . 0.0 111.538 -176.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.642 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 52.7 m -57.93 118.47 5.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.329 0.585 . . . . 0.0 111.225 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.662 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 24.3 mmt180 -93.51 143.87 25.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.648 176.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.1 p -122.79 150.82 42.3 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 170.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.614 ' HB3' HD22 ' A' ' 124' ' ' ASN . 31.4 mt -71.03 -29.9 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.051 0.453 . . . . 0.0 109.974 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 p -61.86 -19.42 62.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.425 175.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.25 -38.34 16.41 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.724 0.773 . . . . 0.0 109.848 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.66 HD21 HG13 ' A' ' 38' ' ' VAL . 11.5 tp -78.55 -1.51 34.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.884 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.536 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 36.1 ttpt -64.77 -10.59 28.83 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.476 0.655 . . . . 0.0 111.068 179.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.11 -15.27 60.45 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.917 -0.658 . . . . 0.0 111.734 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -132.2 -179.23 5.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.416 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.508 HG22 ' HB3' ' A' ' 122' ' ' ARG . 99.7 t -84.8 128.9 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 170.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.66 HG13 HD21 ' A' ' 33' ' ' LEU . 43.6 t -106.57 122.77 60.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.292 0.568 . . . . 0.0 112.396 -162.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.615 HD13 HD23 ' A' ' 136' ' ' LEU . 13.3 tp -95.08 116.94 29.36 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.93 172.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.595 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 20.7 mm -91.4 106.34 17.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 178.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.519 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.0 t70 -107.53 141.38 39.06 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.73 0.3 . . . . 0.0 111.101 -178.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -128.46 111.84 13.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.699 174.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 t -154.84 175.09 14.18 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.937 0.399 . . . . 0.0 111.006 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.55 HG21 ' HB2' ' A' ' 47' ' ' ASN . 7.9 m -112.98 121.68 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.923 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -75.99 83.83 2.88 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 173.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 179.98 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.684 -167.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.55 ' HB2' HG21 ' A' ' 44' ' ' VAL . 2.1 t-20 -88.5 149.61 23.54 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.387 -168.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.01 -29.97 69.1 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.67 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.7 -25.55 64.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.555 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 m -67.85 -27.49 66.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.14 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.22 -54.59 38.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.63 -38.03 86.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.171 0.51 . . . . 0.0 110.568 178.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.419 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.4 t60 -61.6 -40.91 96.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.711 179.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.574 ' HA ' HD13 ' A' ' 57' ' ' LEU . 18.2 t-20 -71.33 -34.72 70.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.749 -178.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.58 -41.76 92.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.29 80.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.328 0.585 . . . . 0.0 110.205 176.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.574 HD13 ' HA ' ' A' ' 54' ' ' ASN . 58.8 mt -67.34 -39.67 85.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.663 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.471 ' HA ' ' HD3' ' A' ' 58' ' ' ARG . 3.3 tpp180 -61.31 -24.96 66.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.289 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -74.46 -56.11 5.22 Favored 'General case' 0 CA--C 1.488 -1.436 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.637 HD11 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -56.19 -29.14 60.49 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-N 111.749 -2.478 . . . . 0.0 111.11 177.146 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.411 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 37.6 t80 -76.38 -52.95 8.87 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.439 -178.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.452 ' OD1' ' HD2' ' A' ' 58' ' ' ARG . 5.9 m-20 -62.48 -22.38 66.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.171 0.51 . . . . 0.0 110.369 -178.341 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -81.19 -62.05 1.77 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.832 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.608 ' HB3' ' CD1' ' A' ' 144' ' ' LEU . 87.9 m-85 -107.76 -8.08 16.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -163.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.512 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.48 -16.89 64.46 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.706 -0.621 . . . . 0.0 111.428 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.8 m -85.56 5.6 30.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.525 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -118.41 14.83 13.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.214 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.17 43.01 3.88 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.832 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.512 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 83.3 t80 -127.91 138.81 52.79 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -177.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -145.24 141.59 28.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 0.0 109.847 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.468 HD13 ' CE3' ' A' ' 92' ' ' TRP . 56.3 mt -99.06 132.79 43.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.941 -174.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.506 ' HB2' ' CD2' ' A' ' 33' ' ' LEU . 90.1 t80 -111.02 101.43 9.99 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.067 177.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.519 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 6.1 tt0 -102.72 119.11 38.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.15 0.5 . . . . 0.0 111.399 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.42 HD12 HG22 ' A' ' 18' ' ' ILE . 69.9 mt -96.69 127.93 48.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.777 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.0 m -100.37 129.63 46.37 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.401 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.539 HD11 HD13 ' A' ' 114' ' ' LEU . 0.7 OUTLIER -123.86 22.28 8.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.075 0.464 . . . . 0.0 110.461 177.569 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.48 ' HB3' ' HB ' ' A' ' 44' ' ' VAL . 4.6 p-10 -79.09 178.68 7.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.085 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.09 30.84 5.7 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.608 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -135.64 102.49 5.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.639 . . . . 0.0 111.028 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.419 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 28.5 tt0 -69.81 -18.33 63.46 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.876 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -70.09 -59.5 2.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.931 -176.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -66.32 -36.06 81.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.502 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.521 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 33.2 t90 -57.56 -60.05 4.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.866 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.419 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 31.6 ttmt -61.17 -44.19 97.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.144 -174.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.3 m -62.41 -49.13 76.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.439 -178.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.622 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.1 t -70.82 -45.94 63.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.618 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.411 ' HB1' ' HB2' ' A' ' 94' ' ' CYS . . . -58.85 -40.58 84.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -175.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.33 -28.84 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.294 0.569 . . . . 0.0 110.611 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -96.99 7.26 47.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.306 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 86' ' ' SER . 32.3 mt -100.01 153.59 37.68 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-O 121.177 0.513 . . . . 0.0 111.837 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.596 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.6 Cg_endo -75.17 -45.32 0.28 Allowed 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 123.958 3.106 . . . . 0.0 114.005 -176.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.596 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.0 p90 -94.96 -171.04 2.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.443 . . . . 0.0 112.021 -171.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.2 t -80.05 124.83 38.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.668 -174.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.411 ' HB2' ' HB1' ' A' ' 87' ' ' ALA . 39.1 m -123.44 109.4 13.8 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.379 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.409 HG11 ' HA ' ' A' ' 22' ' ' ASP . 18.6 m -122.31 161.51 23.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.885 -177.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.419 HH12 ' HB2' ' A' ' 80' ' ' GLU . 59.4 ttp180 -124.47 144.21 50.21 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.054 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.97 163.44 24.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.125 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.0 -32.82 30.39 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -177.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.52 ' HB3' ' HB2' ' A' ' 102' ' ' TYR . 64.9 m-20 -113.75 -12.41 12.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.691 0.281 . . . . 0.0 111.488 -172.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.83 -116.3 5.58 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.207 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.29 -14.34 62.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.064 0.459 . . . . 0.0 111.118 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.52 ' HB2' ' HB3' ' A' ' 99' ' ' ASN . 97.8 m-85 -96.5 19.64 11.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.369 177.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.461 ' HB3' HG13 ' A' ' 106' ' ' ILE . 45.4 t -66.79 138.99 57.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.016 -178.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.572 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.9 m -67.61 -25.84 65.95 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.281 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.495 ' HA ' HD11 ' A' ' 108' ' ' LEU . 98.0 m-85 -61.7 -42.3 98.76 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.203 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.461 HG13 ' HB3' ' A' ' 103' ' ' SER . 67.5 mt -59.94 -32.72 50.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.841 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.2 m -76.81 -33.3 57.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.852 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -62.92 -39.5 94.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.735 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.526 ' OH ' HD11 ' A' ' 18' ' ' ILE . 68.3 m-85 -81.57 -19.42 42.04 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.438 178.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 t30 . . . . . 0 CA--C 1.512 -0.504 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -166.082 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.655 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 80.0 mt . . . . . 0 CA--C 1.534 0.34 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.655 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.96 153.94 96.23 Favored 'Cis proline' 0 C--N 1.355 0.891 0 CA-C-N 120.005 1.037 . . . . 0.0 113.202 0.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 69.1 m -145.13 172.91 12.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.481 -177.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.48 HG13 ' HA3' ' A' ' 130' ' ' GLY . 2.7 p -142.31 158.75 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.595 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 95.3 m-85 -140.96 161.95 36.63 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 176.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.775 HD11 HD13 ' A' ' 136' ' ' LEU . 17.0 tp -111.05 134.56 52.55 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.175 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 16.8 t -131.1 119.07 43.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.886 0.374 . . . . 0.0 110.182 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.597 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 3.5 p30 -74.69 164.44 26.58 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.508 ' HB3' HG22 ' A' ' 37' ' ' VAL . 18.0 ptt180 -52.56 -19.19 2.12 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 124.429 1.081 . . . . 0.0 113.795 -171.494 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -84.3 11.49 8.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.068 0.461 . . . . 0.0 109.907 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.614 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.8 t-20 57.79 55.35 5.5 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.161 -176.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.597 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 31.7 mt-10 -129.06 146.74 50.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.554 178.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.3 mt -72.61 112.09 8.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.171 0.51 . . . . 0.0 111.029 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.624 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 9.9 m -74.3 -56.87 4.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.527 177.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.94 170.93 11.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.909 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.55 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 14.7 mmt180 -82.89 152.67 25.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.48 ' HA3' HG13 ' A' ' 117' ' ' VAL . . . -62.28 -34.04 87.97 Favored Glycine 0 CA--C 1.509 -0.337 0 N-CA-C 111.712 -0.555 . . . . 0.0 111.712 177.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 131' ' ' GLU . 17.8 mp0 -64.35 -28.68 69.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.682 -0.759 . . . . 0.0 110.21 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -99.47 -6.32 27.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.752 -171.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 129' ' ' ARG . 85.0 mt -102.76 108.52 24.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.182 -179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 18.5 pttp -64.17 -48.56 75.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.942 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 7.3 m-20 -127.77 107.38 9.84 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.775 HD13 HD11 ' A' ' 119' ' ' LEU . 7.3 tp -74.92 -34.6 62.14 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -178.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.605 ' HA ' HD13 ' A' ' 60' ' ' LEU . 11.5 t70 -46.93 -58.2 4.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.682 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -62.72 -45.37 93.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.562 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.7 -52.24 64.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.695 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.709 HD11 ' HG ' ' A' ' 136' ' ' LEU . 52.5 mt -57.82 -45.83 87.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 0.0 110.395 177.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 66.7 tttm -52.69 -46.52 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.934 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 34.3 mttm -71.5 -29.37 64.73 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 81.4 mt -65.22 -41.72 94.13 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.787 0.803 . . . . 0.0 109.484 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.608 ' CD1' ' HB3' ' A' ' 64' ' ' TYR . 70.8 mt . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.879 -178.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.551 HD11 ' O ' ' A' ' 124' ' ' ASN . 2.4 tt . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.971 0.415 . . . . 0.0 110.869 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.482 ' N ' HD12 ' A' ' 16' ' ' ILE . 3.7 mp -107.05 114.08 45.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 171.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.47 108.46 14.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.119 0.485 . . . . 0.0 109.953 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 29' ' ' SER . 7.0 mt -94.93 124.9 47.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.612 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -120.97 99.21 6.37 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.546 -177.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.456 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 43.3 mt -131.09 159.1 38.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.9 mttp -90.19 142.57 27.58 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.04 0.448 . . . . 0.0 111.904 -178.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.566 ' OD1' ' HG2' ' A' ' 24' ' ' LYS . 15.9 t70 -75.88 176.89 7.41 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.092 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.908 HD12 ' HB2' ' A' ' 87' ' ' ALA . 3.0 mm? -46.81 -39.77 12.49 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 123.608 0.763 . . . . 0.0 110.889 177.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.566 ' HG2' ' OD1' ' A' ' 22' ' ' ASP . 30.6 mmtm -60.08 -48.92 79.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.954 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 9.62 3.97 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.831 -0.907 . . . . 0.0 110.831 -176.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.425 ' OD1' ' HB3' ' A' ' 22' ' ' ASP . 2.2 p30 -103.5 130.72 50.93 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.8 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.579 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 42.2 m -70.08 128.95 38.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.206 0.527 . . . . 0.0 111.313 -178.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.539 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 15.3 mmm180 -112.18 132.99 54.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.984 175.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.468 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.7 p -121.53 163.49 18.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.785 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.463 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 73.6 mt -76.11 -28.78 57.63 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 177.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 p -67.14 -14.58 63.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.371 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.02 -32.01 19.02 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.504 ' HB3' HG22 ' A' ' 38' ' ' VAL . 4.0 mp -90.71 10.04 27.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.905 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.63 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.4 ttmm -72.86 128.25 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.137 0.494 . . . . 0.0 110.372 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.07 -20.38 9.17 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 -172.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -109.22 168.71 9.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.922 -0.639 . . . . 0.0 110.376 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.77 HG23 ' HD2' ' A' ' 122' ' ' ARG . 80.6 t -91.34 118.58 36.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 169.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.723 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 95.2 t -111.5 131.38 62.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 121.716 0.769 . . . . 0.0 112.129 -169.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.9 tt -92.27 110.0 21.39 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.159 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.639 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 3.0 mp -84.19 106.49 14.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 175.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.601 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 26.1 t0 -98.55 144.74 27.54 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.601 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.536 ' HB3' HD22 ' A' ' 114' ' ' LEU . 21.7 m-85 -133.41 105.85 7.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 175.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.9 t -154.18 155.82 35.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.148 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.506 HG11 HD21 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -96.79 118.89 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.139 172.721 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -66.71 87.77 0.13 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 170.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 177.82 -35.51 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.102 -1.408 . . . . 0.0 109.157 -168.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -89.01 142.3 27.76 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.207 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.42 -29.81 64.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.961 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.4 mmm -64.32 -20.13 65.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.602 0.239 . . . . 0.0 111.337 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.4 t -64.99 -27.16 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.31 -50.17 61.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.388 . . . . 0.0 110.598 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.36 -29.41 69.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.418 0.627 . . . . 0.0 110.314 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.552 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 62.5 t60 -68.08 -47.38 68.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.5 176.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.56 ' HA ' HD13 ' A' ' 57' ' ' LEU . 5.2 m-20 -65.37 -27.14 68.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.985 178.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.76 -53.68 54.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.407 0.622 . . . . 0.0 109.886 174.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.95 74.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.662 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.56 HD13 ' HA ' ' A' ' 54' ' ' ASN . 93.2 mt -63.92 -39.57 94.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.882 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -64.23 -26.04 68.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.728 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.568 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 5.1 tt0 -78.02 -50.46 12.06 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -177.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.406 ' HA ' ' HD2' ' A' ' 63' ' ' LYS . 19.0 mt -53.72 -34.47 58.97 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 112.448 -2.16 . . . . 0.0 111.179 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.468 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 35.5 t80 -67.67 -45.76 74.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.275 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -68.04 -21.28 65.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.998 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.568 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 60.7 mttm -85.49 -61.15 1.83 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.679 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.547 ' HB3' HD12 ' A' ' 144' ' ' LEU . 66.8 m-85 -106.27 -14.8 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -163.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.543 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.35 169.7 11.78 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.92 -177.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 24.7 m 72.82 -35.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.386 0.675 . . . . 0.0 111.46 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.447 ' H ' ' C ' ' A' ' 65' ' ' ALA . 47.6 mt-30 -81.87 11.03 5.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 110.944 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.4 47.53 1.3 Allowed Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.669 -176.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.543 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 64.5 t80 -141.43 134.65 29.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -143.55 150.05 38.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.488 HD11 ' CE3' ' A' ' 92' ' ' TRP . 58.5 mt -110.36 127.38 67.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.075 0.464 . . . . 0.0 110.299 -177.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.452 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.8 t80 -119.56 100.59 7.37 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.495 -176.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.601 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 44.1 mt-30 -93.29 117.01 29.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.234 -175.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.436 HD12 ' CE2' ' A' ' 72' ' ' TYR . 16.7 mm -86.58 113.96 25.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.651 171.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 42.2 t -105.11 111.6 24.42 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.334 0.588 . . . . 0.0 110.781 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.508 HD11 ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -102.74 39.3 1.55 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.548 177.047 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.434 ' HA ' HG13 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -50.31 -73.77 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.289 -1.323 . . . . 0.0 113.621 -173.697 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 124.94 -7.07 8.24 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 111.107 -0.797 . . . . 0.0 111.107 -172.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -142.34 119.12 11.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 20.9 tt0 -68.08 -41.74 81.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.955 -173.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 -79.9 -24.33 41.2 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -168.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -70.95 -48.83 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.56 ' CZ2' HD11 ' A' ' 23' ' ' LEU . 12.5 t90 -61.83 -47.07 86.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.891 176.238 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.896 ' HA ' HD13 ' A' ' 23' ' ' LEU . 60.3 tttt -62.13 -44.27 97.01 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.4 p -69.75 -41.09 75.67 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.91 0.386 . . . . 0.0 111.397 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.7 p -76.7 -42.79 40.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.857 -176.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.908 ' HB2' HD12 ' A' ' 23' ' ' LEU . . . -79.57 -24.63 41.96 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -171.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.4 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 24.6 t70 -71.8 -8.78 56.34 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.506 0.67 . . . . 0.0 110.442 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -101.8 9.94 40.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.119 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.854 ' HG ' ' O ' ' A' ' 87' ' ' ALA . 3.7 pp -98.44 158.2 33.03 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.968 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.732 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 32.5 Cg_endo -85.03 -3.06 9.66 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 124.062 3.174 . . . . 0.0 114.693 -172.06 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.802 ' CD1' HD11 ' A' ' 90' ' ' LEU . 2.4 p90 -122.55 -153.64 0.56 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.539 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 83.9 t -103.28 134.3 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -177.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.469 ' HB3' HD22 ' A' ' 23' ' ' LEU . 39.1 t -137.93 112.86 9.06 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.45 0.643 . . . . 0.0 109.539 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.456 ' CG2' ' HB2' ' A' ' 20' ' ' LEU . 27.4 m -114.6 148.07 17.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.896 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.467 ' HD2' ' CE3' ' A' ' 83' ' ' TRP . 36.1 ttt180 -100.24 137.49 38.61 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.92 0.391 . . . . 0.0 111.215 -174.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.405 ' CG ' ' HG ' ' A' ' 103' ' ' SER . 21.5 t70 -87.09 146.01 26.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.265 178.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.64 -28.36 30.77 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.414 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 4.8 m-20 -91.53 -13.83 31.42 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -171.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 54.84 72.75 0.5 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.451 -0.404 . . . . 0.0 113.357 176.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.491 ' N ' ' HB2' ' A' ' 76' ' ' LEU . . . 78.2 -15.81 0.72 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.721 0.808 . . . . 0.0 111.858 177.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.54 25.24 5.89 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.447 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.9 OUTLIER -66.47 135.13 53.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.116 -176.393 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.604 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 26.2 m -55.65 -36.3 66.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.517 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.55 -46.12 84.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.191 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.447 HG13 ' HB2' ' A' ' 103' ' ' SER . 65.8 mt -57.54 -43.48 83.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.753 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -67.59 -32.25 72.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.103 176.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 104' ' ' SER . 84.9 mt -65.7 -39.71 91.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.278 -179.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.423 ' O ' ' CB ' ' A' ' 110' ' ' ASN . 65.2 m-85 -77.12 -50.96 11.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.558 175.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.423 ' CB ' ' O ' ' A' ' 109' ' ' TYR . 8.6 t30 . . . . . 0 N--CA 1.478 0.941 0 O-C-N 125.525 1.766 . . . . 0.0 108.226 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.536 HD22 ' HB3' ' A' ' 42' ' ' PHE . 2.4 mp . . . . . 0 C--O 1.236 0.39 0 CA-C-O 120.556 0.217 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -73.78 159.03 98.16 Favored 'Cis proline' 0 C--N 1.35 0.646 0 C-N-CA 123.249 -1.563 . . . . 0.0 112.053 0.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.8 m -145.81 175.76 10.17 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.567 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.9 p -143.11 155.12 17.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.639 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 93.3 m-85 -133.8 155.63 49.46 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.971 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 5.1 tp -118.41 143.93 46.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.318 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.723 ' CG2' ' HB ' ' A' ' 38' ' ' VAL . 14.5 m -138.99 140.15 39.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.078 0.466 . . . . 0.0 110.115 167.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.547 ' HB3' HD21 ' A' ' 143' ' ' LEU . 1.1 p-10 -89.49 178.29 6.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.859 -176.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.77 ' HD2' HG23 ' A' ' 37' ' ' VAL . 9.8 mmm180 -38.14 -48.2 1.22 Allowed 'General case' 0 N--CA 1.481 1.115 0 O-C-N 124.808 1.318 . . . . 0.0 113.813 -171.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.49 9.5 1.04 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.453 -176.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.63 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 1.6 t-20 54.28 57.95 5.4 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 123.594 0.758 . . . . 0.0 110.305 -171.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -128.09 140.15 52.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.716 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.547 ' HA ' HG13 ' A' ' 120' ' ' VAL . 3.8 tt -62.12 121.02 12.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.681 0.753 . . . . 0.0 111.295 -170.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.971 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 68.8 m -84.92 -54.58 4.57 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.436 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.487 ' HB2' ' OD1' ' A' ' 132' ' ' ASN . . . -168.98 173.6 6.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 -174.079 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.482 ' O ' HG13 ' A' ' 133' ' ' ILE . 89.7 mtt180 -110.58 158.83 18.14 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.805 -178.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.83 -14.99 32.71 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.06 173.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.25 -28.03 62.88 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 122.469 0.308 . . . . 0.0 111.033 176.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.487 ' OD1' ' HB2' ' A' ' 128' ' ' ALA . 24.6 p30 -127.57 -7.12 5.72 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.707 HG23 ' HG ' ' A' ' 136' ' ' LEU . 89.8 mt -78.8 108.63 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.506 ' H ' ' HD2' ' A' ' 134' ' ' LYS . 0.1 OUTLIER -58.42 -51.11 71.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.797 0.808 . . . . 0.0 110.009 178.122 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.538 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 9.8 t70 -154.38 124.91 6.99 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.137 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.707 ' HG ' HG23 ' A' ' 133' ' ' ILE . 5.7 mp -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.74 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -48.55 -52.69 21.46 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 123.051 0.219 . . . . 0.0 111.409 174.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -69.66 -38.79 77.22 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.321 0.581 . . . . 0.0 111.542 -179.156 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.637 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -62.81 -53.2 57.97 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.854 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 136' ' ' LEU . 41.7 mt -62.0 -32.03 53.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.271 0.558 . . . . 0.0 110.397 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -58.8 -43.08 90.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.412 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? -84.65 -18.84 34.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.203 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 30.8 mt -73.18 -41.84 63.4 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.25 178.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.547 HD12 ' HB3' ' A' ' 64' ' ' TYR . 21.1 mt . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 121.434 0.635 . . . . 0.0 109.72 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.797 HG13 ' HG ' ' A' ' 126' ' ' LEU . 12.1 tt . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.469 ' N ' HD12 ' A' ' 16' ' ' ILE . 3.6 mp -101.5 109.03 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 172.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.438 ' HA ' HD12 ' A' ' 30' ' ' LEU . 25.8 t0 -73.51 131.97 42.36 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.502 HD13 ' HH ' ' A' ' 109' ' ' TYR . 7.3 mt -113.29 111.58 36.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.138 -175.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.549 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.2 mp0 -98.87 100.16 11.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.296 178.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.95 154.39 51.12 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 89.7 mttt -85.34 143.19 28.81 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.925 0.393 . . . . 0.0 110.854 -175.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.467 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.4 p-10 -76.68 -167.13 0.76 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.929 -178.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.63 HD11 ' HA ' ' A' ' 84' ' ' LYS . 36.9 tp -56.67 -36.32 69.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -79.66 -33.52 41.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.675 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.46 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 116.49 20.24 5.13 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.065 -177.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -95.92 114.87 26.63 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 175.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.7 m -61.99 115.49 4.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.357 0.599 . . . . 0.0 111.182 178.024 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.549 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 18.8 mmm180 -92.27 142.1 27.84 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.501 175.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.5 p -120.1 159.5 24.7 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 172.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.556 ' HB3' HD22 ' A' ' 124' ' ' ASN . 71.7 mt -80.91 -28.79 35.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.689 0.281 . . . . 0.0 111.229 -177.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.87 0.64 8.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.97 0.414 . . . . 0.0 111.241 175.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -83.45 -50.34 8.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.667 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.583 ' HG ' HG23 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -98.73 26.02 6.02 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.854 0.835 . . . . 0.0 110.277 -176.839 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.593 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 30.3 ttpt -59.47 -26.57 65.35 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 113.976 -1.465 . . . . 0.0 112.514 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -56.5 -21.72 35.8 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 116.279 -0.419 . . . . 0.0 113.866 -176.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -138.41 -169.66 2.64 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 116.859 0.329 . . . . 0.0 110.522 178.483 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.652 HG23 ' HD1' ' A' ' 69' ' ' PHE . 27.6 m -82.52 143.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 -176.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.583 HG23 ' HG ' ' A' ' 33' ' ' LEU . 21.5 t -119.98 137.89 52.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.975 -173.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.65 HD21 ' HZ ' ' A' ' 69' ' ' PHE . 12.7 tp -102.66 106.2 16.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.969 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.605 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.2 mm -84.74 106.47 14.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.573 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 5.1 t70 -108.42 135.08 50.31 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.705 0.288 . . . . 0.0 111.032 -175.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.544 ' HB3' HD11 ' A' ' 76' ' ' LEU . 59.8 m-85 -123.13 99.92 6.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.573 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 15.8 m -138.81 149.66 45.19 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.018 0.437 . . . . 0.0 111.847 -170.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.52 HG21 ' HB2' ' A' ' 47' ' ' ASN . 13.7 m -96.13 115.71 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 121.178 0.513 . . . . 0.0 110.755 176.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.518 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 36.7 m-85 -78.73 85.4 4.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.576 0.703 . . . . 0.0 109.477 176.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 178.25 -34.69 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.352 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.52 ' HB2' HG21 ' A' ' 44' ' ' VAL . 2.7 t-20 -84.04 163.45 19.89 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.698 -171.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.83 -30.4 40.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.339 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.6 tpt -62.5 -26.53 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.738 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 m -60.79 -34.13 74.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.141 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.64 -52.22 65.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.633 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.83 81.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.856 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.419 ' HE2' ' CG ' ' A' ' 41' ' ' ASP . 73.5 t60 -61.97 -51.57 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.81 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.556 ' HA ' HD11 ' A' ' 57' ' ' LEU . 5.0 m-20 -75.01 -18.01 60.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.589 -177.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.47 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 1.8 tm? -69.03 -51.34 40.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.02 -39.17 84.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.502 178.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.556 HD11 ' HA ' ' A' ' 54' ' ' ASN . 96.2 mt -60.65 -38.95 86.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.086 174.168 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.47 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 7.5 tpp180 -62.83 -27.83 69.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.563 179.128 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -78.13 -51.01 10.9 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.703 HD13 HD12 ' A' ' 140' ' ' ILE . 2.9 mm? -56.09 -32.27 63.99 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 112.735 -2.03 . . . . 0.0 111.07 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.506 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 30.5 t80 -70.21 -49.12 53.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.084 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -64.03 -21.41 66.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.654 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -84.05 -61.74 1.74 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.063 -177.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.511 ' HB3' HD12 ' A' ' 144' ' ' LEU . 84.9 m-85 -113.84 -18.2 11.86 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -166.023 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.481 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.57 161.5 29.45 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.004 -176.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.5 m 77.73 -34.76 0.2 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.529 0.732 . . . . 0.0 111.543 -177.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.416 HE21 ' HB2' ' A' ' 67' ' ' GLN . 1.6 mp0 -85.24 11.04 10.79 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.068 177.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.583 ' O ' ' HB2' ' A' ' 36' ' ' LYS . . . 121.47 27.53 1.78 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.35 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.652 ' HD1' HG23 ' A' ' 37' ' ' VAL . 56.2 t80 -134.98 130.06 35.17 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 176.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.58 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 3.0 tt0 -133.3 156.26 47.92 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.261 178.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.468 HD11 ' CE3' ' A' ' 92' ' ' TRP . 54.2 mt -120.78 131.6 72.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.391 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.459 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 66.2 t80 -121.17 101.02 7.39 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.09 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HG3' ' HB3' ' A' ' 41' ' ' ASP . 7.3 tt0 -105.91 145.76 30.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.014 0.435 . . . . 0.0 111.052 -176.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.5 mt -126.51 127.58 70.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.959 -177.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.518 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 2.6 p -85.34 121.81 28.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.962 0.41 . . . . 0.0 110.955 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.563 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 12.1 mt -110.39 9.07 23.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.387 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.478 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.0 OUTLIER -68.66 -68.71 0.38 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.05 -175.808 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.64 23.24 6.02 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -174.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -134.57 98.85 4.18 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.525 ' HG2' ' CE3' ' A' ' 83' ' ' TRP . 25.8 mt-10 -75.35 -14.47 60.48 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.677 -176.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -50.87 66.78 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.002 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -81.78 -30.48 32.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.225 -177.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.534 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 42.6 t90 -66.16 -52.0 52.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.097 175.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.63 ' HA ' HD11 ' A' ' 23' ' ' LEU . 19.1 ttmm -64.17 -43.47 95.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.934 -173.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.9 p -65.05 -43.24 92.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.666 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.419 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 38.1 t -74.46 -37.13 63.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.532 -178.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.483 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -69.91 -29.07 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -174.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.44 -23.02 66.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.305 0.574 . . . . 0.0 110.764 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -92.38 -8.18 45.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.83 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 86' ' ' SER . 34.8 mt -76.75 146.4 76.28 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.659 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 20.0 Cg_endo -91.25 -17.06 1.24 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 124.423 3.415 . . . . 0.0 113.523 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.659 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.4 p90 -115.93 -170.32 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.7 0.286 . . . . 0.0 110.94 -175.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.445 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 60.3 t -81.24 122.27 36.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.072 -176.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 49.8 t -125.8 109.31 12.39 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.957 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.467 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 17.2 m -117.63 158.75 18.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.892 -178.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.445 ' HA ' ' OG ' ' A' ' 75' ' ' SER . 19.0 ttp180 -107.91 136.23 47.97 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.139 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -80.77 155.54 26.63 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.55 -20.46 36.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.763 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.502 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 3.3 m-80 -122.19 -12.94 8.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.579 -173.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.563 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 70.97 -129.89 18.9 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.619 -0.8 . . . . 0.0 111.887 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.26 -5.63 29.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.851 0.357 . . . . 0.0 111.379 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -102.53 12.72 36.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.241 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.534 ' HB3' HG13 ' A' ' 106' ' ' ILE . 34.7 t -62.97 134.66 56.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.055 -177.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.492 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 8.0 m -61.26 -26.99 68.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.741 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.437 ' CZ ' HG23 ' A' ' 18' ' ' ILE . 64.1 m-85 -60.5 -45.09 95.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.611 178.283 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.534 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.6 mt -61.15 -36.0 69.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.508 -177.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.6 m -68.16 -35.64 78.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.724 178.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.5 mt -65.06 -35.25 80.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.439 -178.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.502 ' HH ' HD13 ' A' ' 18' ' ' ILE . 93.4 m-85 -74.24 -20.43 60.17 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.145 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.458 ' C ' HD21 ' A' ' 110' ' ' ASN . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.194 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -167.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.675 HD23 ' HB2' ' A' ' 116' ' ' SER . 64.9 mt . . . . . 0 C--O 1.234 0.246 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.573 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 20.4 Cg_exo -67.4 147.24 77.81 Favored 'Cis proline' 0 C--N 1.352 0.723 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.143 0.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.675 ' HB2' HD23 ' A' ' 114' ' ' LEU . 8.8 m -142.22 177.94 7.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.765 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.496 HG11 HD21 ' A' ' 136' ' ' LEU . 4.5 p -135.44 162.13 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.844 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.605 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 63.9 m-85 -138.78 160.22 40.21 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 175.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.827 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -110.44 139.0 46.08 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.473 -174.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.601 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 52.9 t -127.75 118.83 50.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.947 176.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.442 ' C ' ' H ' ' A' ' 123' ' ' ASN . 4.1 p-10 -76.75 162.63 27.52 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.987 176.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -69.78 27.82 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -167.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . 0.442 ' H ' ' C ' ' A' ' 121' ' ' ASN . 16.8 m120 -123.84 14.44 9.29 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 174.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.593 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 2.6 t-20 53.24 61.66 3.04 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.168 -169.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 68.6 mt-10 -130.88 150.74 51.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.175 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.797 ' HG ' HG13 ' A' ' 15' ' ' ILE . 24.7 mt -72.37 119.67 16.91 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.125 0.488 . . . . 0.0 110.103 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.827 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 35.5 m -83.42 -51.26 7.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.344 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -170.02 172.78 6.31 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.02 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.502 ' O ' HG13 ' A' ' 133' ' ' ILE . 82.0 mtm180 -103.16 158.39 16.34 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.404 -176.108 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.4 -35.82 73.78 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 121.565 -0.35 . . . . 0.0 112.892 -175.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.466 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.5 pm0 -77.61 -7.08 55.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.117 178.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -105.0 -20.18 13.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.718 HG22 ' HG ' ' A' ' 136' ' ' LEU . 60.5 mt -97.49 138.86 21.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.375 -176.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.59 1.07 4.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.088 0.471 . . . . 0.0 110.032 177.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -144.87 48.93 1.3 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.51 -168.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.718 ' HG ' HG22 ' A' ' 133' ' ' ILE . 3.9 mp -56.43 -38.91 72.24 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -176.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.41 -53.33 57.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.39 . . . . 0.0 110.031 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.488 ' HA ' ' HE2' ' A' ' 141' ' ' LYS . 66.0 mm-40 -62.72 -39.56 94.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.942 175.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 1.01 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.59 -56.9 16.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.648 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.703 HD12 HD13 ' A' ' 60' ' ' LEU . 52.0 mt -56.33 -42.37 73.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.378 0.609 . . . . 0.0 110.492 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.5 ttpt -60.41 -42.43 95.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.447 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 1.01 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 36.5 pttt -80.24 -23.45 40.85 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 120.659 0.266 . . . . 0.0 111.036 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.646 ' HB3' HG12 ' A' ' 37' ' ' VAL . 82.5 mt -70.72 -40.54 72.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.715 176.321 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 90.9 mt . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.921 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.4 tp . . . . . 0 N--CA 1.446 -0.671 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.496 HD11 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -101.16 105.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 176.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -76.11 111.07 11.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.257 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.2 mt -108.4 130.44 61.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.945 -177.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.519 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 12.8 mp0 -111.56 100.7 9.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.514 -178.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.4 mt -130.06 154.64 47.23 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 26' ' ' ASN . 92.8 mttt -88.79 146.57 24.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.804 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.738 ' OD2' ' HG2' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -85.45 -172.47 4.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 179.777 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.594 ' HB3' ' HZ3' ' A' ' 24' ' ' LYS . 55.3 tp -51.43 -36.51 44.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.931 177.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.738 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 25.9 mmtm -72.79 -43.13 63.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.473 0.654 . . . . 0.0 110.012 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 125.62 11.16 4.17 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.665 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.524 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 39.6 m-80 -83.43 113.33 20.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 178.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.486 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 16.1 m -64.55 107.35 1.37 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.118 0.485 . . . . 0.0 110.02 173.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.519 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 17.6 mmm180 -93.02 138.57 31.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.163 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.504 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 2.9 p -118.29 154.18 32.72 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.466 HD12 ' O ' ' A' ' 16' ' ' ILE . 82.3 mt -77.37 -30.98 54.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.853 0.358 . . . . 0.0 110.738 -176.262 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.5 t -74.89 0.24 16.27 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.141 0.496 . . . . 0.0 110.67 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -87.97 -51.23 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.424 ' O ' ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -85.17 12.38 8.02 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 122.057 0.932 . . . . 0.0 110.644 -176.455 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.43 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 25.9 ttpp -56.27 124.08 16.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.728 169.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.71 -40.12 1.17 Allowed Glycine 0 CA--C 1.495 -1.217 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -172.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.484 ' HB2' ' C ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -119.27 173.67 6.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 172.592 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.647 HG23 ' HD1' ' A' ' 69' ' ' PHE . 17.1 m -75.87 136.37 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.947 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.419 HG21 ' HG ' ' A' ' 33' ' ' LEU . 33.0 t -116.76 123.69 71.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.94 -171.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.608 ' HB3' HG23 ' A' ' 71' ' ' ILE . 10.5 tp -87.17 112.7 22.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.751 175.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.58 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.3 mm -87.36 105.08 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.57 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 18.1 t70 -109.65 134.88 51.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.761 0.315 . . . . 0.0 111.033 -175.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.516 ' HB3' HD13 ' A' ' 114' ' ' LEU . 61.7 m-85 -122.35 99.1 6.24 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.887 ' O ' ' HA ' ' A' ' 75' ' ' SER . 20.6 m -139.71 143.68 37.17 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.107 0.48 . . . . 0.0 111.5 -169.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.682 HG12 ' HB2' ' A' ' 47' ' ' ASN . 3.4 p -96.81 120.96 46.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 O-C-N 121.978 -0.451 . . . . 0.0 110.138 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.576 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 48.3 m-85 -77.22 79.38 3.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.749 0.785 . . . . 0.0 109.46 176.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -178.75 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.884 -1.507 . . . . 0.0 109.112 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.682 ' HB2' HG12 ' A' ' 44' ' ' VAL . 38.5 t-20 -65.41 140.43 58.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.627 -179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.89 -35.43 80.63 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.484 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -67.85 -19.89 65.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.065 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 m -68.03 -29.09 67.99 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.138 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.6 -55.58 16.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.832 0.349 . . . . 0.0 110.851 -178.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.07 86.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 0.0 110.711 178.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.614 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 72.1 t60 -61.58 -38.99 89.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.952 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.487 ' HA ' HD11 ' A' ' 57' ' ' LEU . 21.7 t-20 -68.73 -30.33 68.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.544 0.211 . . . . 0.0 110.712 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tt -69.74 -41.84 74.73 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.27 80.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.388 176.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 76.6 mt -67.98 -39.44 83.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.481 176.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.407 ' HE ' ' HB2' ' A' ' 58' ' ' ARG . 2.0 tpp180 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.13 -52.96 12.28 Favored 'General case' 0 CA--C 1.493 -1.237 0 CA-C-O 122.743 1.258 . . . . 0.0 108.08 -173.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.858 HD12 HD13 ' A' ' 140' ' ' ILE . 2.3 mm? -55.76 -31.7 62.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 112.219 -2.264 . . . . 0.0 110.888 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -75.25 -50.12 17.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.894 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -61.15 -22.03 64.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.529 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -81.67 -60.74 2.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.077 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -104.66 -7.69 19.43 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -166.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.531 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.88 165.8 16.88 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.491 -0.483 . . . . 0.0 111.169 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 56.9 m 70.89 -10.95 0.69 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.779 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.423 ' H ' ' C ' ' A' ' 65' ' ' ALA . 24.0 mt-30 -105.18 3.44 30.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.956 0.408 . . . . 0.0 110.729 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.539 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 114.3 45.73 0.66 Allowed Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.647 ' HD1' HG23 ' A' ' 37' ' ' VAL . 83.1 t80 -138.25 130.43 28.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.874 0.369 . . . . 0.0 110.822 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.43 ' HB3' ' HD3' ' A' ' 36' ' ' LYS . 22.4 tt0 -144.95 157.32 44.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.006 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.608 HG23 ' HB3' ' A' ' 39' ' ' LEU . 58.2 mt -127.45 136.43 60.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.305 -171.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.531 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 50.0 t80 -123.52 102.1 7.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.499 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.57 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.1 mt-30 -93.74 141.97 27.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 111.578 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.5 mt -122.26 122.17 65.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.038 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.887 ' HA ' ' O ' ' A' ' 43' ' ' THR . 78.7 p -99.73 142.01 31.78 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -175.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.733 HD13 HD12 ' A' ' 114' ' ' LEU . 81.5 mt -110.71 31.54 5.91 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.249 0.547 . . . . 0.0 109.565 172.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.532 ' HA ' HG23 ' A' ' 44' ' ' VAL . 5.3 p-10 -73.1 144.64 46.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.184 -173.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -108.31 16.7 34.97 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 164.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -125.69 94.6 4.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.151 -1.024 . . . . 0.0 109.278 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -72.89 -27.06 61.66 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.227 -175.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 -72.68 -32.85 66.12 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.766 -174.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -79.09 -40.53 30.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.534 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 39.9 t90 -61.11 -48.92 79.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.632 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.516 ' HG3' HD11 ' A' ' 23' ' ' LEU . 35.9 ttmt -62.46 -44.36 96.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.887 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 p -75.19 -34.25 61.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.359 . . . . 0.0 111.633 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.628 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 21.8 t -73.04 -44.99 60.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.466 ' HB3' ' SG ' ' A' ' 94' ' ' CYS . . . -67.55 -24.52 65.54 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.208 -178.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -63.39 -38.41 91.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.43 0.633 . . . . 0.0 109.709 176.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -93.99 11.41 29.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.969 -177.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 86' ' ' SER . 20.1 mt -97.64 133.68 23.29 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-O 121.535 0.683 . . . . 0.0 112.294 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.607 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 57.7 Cg_endo -80.45 -31.55 1.55 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 124.312 3.341 . . . . 0.0 113.071 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.607 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.8 p90 -100.77 -167.0 1.37 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.967 -173.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.531 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 54.1 t -81.68 132.72 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.782 -175.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -136.65 100.04 4.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.062 179.4 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.598 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 14.5 m -114.87 151.25 16.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.474 -175.336 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -107.88 137.44 45.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 0.0 111.882 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -92.14 135.43 33.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.036 174.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.77 -4.34 57.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -94.6 -14.78 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.721 -174.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 49.36 66.5 2.2 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.838 174.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.537 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 77.55 -5.17 2.18 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.414 0.685 . . . . 0.0 112.845 175.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -101.01 12.91 36.8 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.47 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.7 OUTLIER -61.96 126.59 27.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.89 -175.77 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.6 m -55.41 -28.88 56.96 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.372 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -61.3 -38.93 88.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.842 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.47 HG13 ' HB2' ' A' ' 103' ' ' SER . 71.9 mt -59.66 -35.06 57.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.839 -178.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.7 m -73.86 -27.6 61.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.929 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.84 -37.81 67.31 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.089 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -77.34 -8.51 57.78 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 121.135 -0.226 . . . . 0.0 110.598 178.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.494 ' C ' HD21 ' A' ' 110' ' ' ASN . 0.2 OUTLIER . . . . . 0 CA--C 1.516 -0.355 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -169.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.733 HD12 HD13 ' A' ' 76' ' ' LEU . 72.1 mt . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.6 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 14.2 Cg_exo -69.35 159.44 88.4 Favored 'Cis proline' 0 C--N 1.354 0.833 0 C-N-CA 124.597 -1.001 . . . . 0.0 113.802 1.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 67.9 m -153.07 174.41 14.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.739 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.9 p -142.15 155.71 19.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.58 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.3 m-85 -136.02 161.88 34.44 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.777 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.2 tp -111.76 133.48 53.96 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 4.2 t -131.29 128.41 61.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.854 0.359 . . . . 0.0 110.322 174.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . 0.53 ' HB3' HD22 ' A' ' 143' ' ' LEU . 10.1 p30 -90.79 174.6 7.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.245 178.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -54.17 -23.23 13.58 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -166.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . 0.529 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 28.0 m-20 -83.82 9.86 10.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.649 0.261 . . . . 0.0 110.513 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.43 ' HB2' ' HD3' ' A' ' 34' ' ' LYS . 1.5 t-20 64.79 35.74 8.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.978 -174.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.529 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 43.9 mt-10 -109.48 138.04 46.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.025 -176.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.85 112.8 3.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.675 0.75 . . . . 0.0 110.85 176.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.777 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 45.7 m -78.01 -55.65 5.12 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.621 178.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.22 14.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.956 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.629 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 0.2 OUTLIER -99.31 159.37 15.05 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.218 178.649 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -55.69 -46.18 83.05 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 121.613 -0.327 . . . . 0.0 113.64 -175.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . 0.629 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.0 OUTLIER -71.78 -29.66 64.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.261 0.553 . . . . 0.0 110.018 179.765 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.451 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -68.33 -39.53 81.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.613 177.318 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.821 HG23 ' HG ' ' A' ' 136' ' ' LEU . 75.3 mt -70.71 147.36 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.535 178.33 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.435 ' HE3' ' HB3' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -140.71 108.5 5.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 171.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.475 ' OD1' ' HB3' ' A' ' 137' ' ' ASP . 15.7 t70 67.7 102.31 0.05 OUTLIER 'General case' 0 C--O 1.233 0.202 0 O-C-N 124.432 1.083 . . . . 0.0 109.867 -168.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.821 ' HG ' HG23 ' A' ' 133' ' ' ILE . 3.8 mp -75.13 -22.24 58.31 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.69 -177.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.475 ' HB3' ' OD1' ' A' ' 135' ' ' ASP . 9.7 t70 -52.73 -53.87 41.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.18 175.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.636 ' HB3' ' HE2' ' A' ' 142' ' ' LYS . 33.1 mm-40 -56.98 -50.4 72.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.331 173.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.522 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -53.89 -54.27 41.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.174 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.858 HD13 HD12 ' A' ' 60' ' ' LEU . 31.0 mt -67.11 -33.54 63.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.043 0.449 . . . . 0.0 110.928 -177.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -65.21 -32.78 74.63 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.402 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.636 ' HE2' ' HB3' ' A' ' 138' ' ' GLU . 54.1 mttm -80.46 -20.45 43.73 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.95 177.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.53 HD22 ' HB3' ' A' ' 121' ' ' ASN . 65.5 mt -73.6 -43.05 60.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.901 177.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 91.9 mt . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.575 178.493 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.448 ' CD1' HG13 ' A' ' 120' ' ' VAL . 10.3 tt . . . . . 0 CA--C 1.535 0.38 0 CA-C-O 121.042 0.449 . . . . 0.0 111.913 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.649 ' H ' HD12 ' A' ' 16' ' ' ILE . 3.9 mp -74.75 103.79 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 173.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.79 108.17 9.63 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.454 HD11 ' HH ' ' A' ' 109' ' ' TYR . 9.1 mt -100.76 116.92 45.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.119 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.536 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 78.7 mt-30 -107.85 101.48 10.76 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.192 0.52 . . . . 0.0 110.82 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.835 ' HB2' HG12 ' A' ' 95' ' ' VAL . 29.6 mt -138.87 162.1 35.65 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.51 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 51.8 mttm -94.25 150.06 20.65 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.344 0.592 . . . . 0.0 111.435 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.555 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -81.24 -170.26 2.66 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.558 177.213 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.658 HD11 ' HE2' ' A' ' 84' ' ' LYS . 44.7 tp -54.82 -39.69 68.78 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.723 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.458 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 52.8 mttp -78.04 -26.95 48.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.445 -176.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 114.54 11.49 11.61 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.114 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.458 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 36.4 m-80 -82.79 110.45 17.83 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.51 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.3 m -68.27 113.55 5.98 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.486 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.6 mmm180 -103.42 139.58 38.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.037 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.536 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 82.4 p -120.48 160.3 23.42 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.576 HD11 ' O ' ' A' ' 16' ' ' ILE . 63.4 mt -80.55 -25.29 38.7 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.745 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.7 p -66.49 -20.17 65.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 173.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -79.28 -40.86 29.44 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 122.232 1.015 . . . . 0.0 108.476 175.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 tp -78.29 6.26 8.64 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.824 -1.534 . . . . 0.0 110.879 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.686 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.5 ttmm -73.96 114.96 12.85 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.344 -177.03 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.61 -25.41 2.29 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -173.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.618 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -117.77 168.24 10.64 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.438 175.75 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.747 HG22 ' HD1' ' A' ' 69' ' ' PHE . 29.4 m -82.92 124.58 39.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 173.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.671 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 72.3 t -113.05 136.92 47.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.565 0.698 . . . . 0.0 112.101 -168.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 39' ' ' LEU . 9.4 tp -98.99 119.18 37.33 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.624 177.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -97.12 104.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -107.68 135.0 49.84 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.626 ' O ' ' HA ' ' A' ' 115' ' ' PRO . 82.9 m-85 -119.04 101.62 8.16 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.1 t -128.63 -178.21 4.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.186 -172.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.554 HG11 ' HB3' ' A' ' 47' ' ' ASN . 0.4 OUTLIER -135.79 117.6 20.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.265 177.456 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.494 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 32.0 m-85 -78.64 80.07 5.03 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.546 0.689 . . . . 0.0 110.689 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -179.67 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.757 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.554 ' HB3' HG11 ' A' ' 44' ' ' VAL . 4.6 t30 -77.51 132.71 38.51 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.562 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.05 -26.68 68.36 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.475 -173.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.91 -32.5 72.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.304 0.573 . . . . 0.0 109.603 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.3 m -68.22 -27.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.733 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.1 43.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.743 0.306 . . . . 0.0 111.042 -177.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.87 -34.09 76.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.48 . . . . 0.0 110.796 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.442 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 76.5 t60 -64.31 -38.75 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.554 ' HA ' HD12 ' A' ' 57' ' ' LEU . 6.2 m-20 -70.89 -18.83 62.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.615 -179.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tt -77.18 -41.75 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.76 82.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.373 0.606 . . . . 0.0 109.814 175.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 54' ' ' ASN . 82.3 mt -65.36 -38.6 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.684 176.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.406 ' HA ' ' CZ3' ' A' ' 92' ' ' TRP . 5.9 tpp180 -61.89 -30.34 70.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.001 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -77.42 -51.61 10.5 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -174.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.846 HD12 HD13 ' A' ' 140' ' ' ILE . 1.8 mm? -56.14 -29.79 61.24 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.675 -2.057 . . . . 0.0 111.625 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -78.71 -46.34 19.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.085 -177.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.35 -22.48 66.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.545 0.688 . . . . 0.0 110.68 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -82.86 -61.06 1.97 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.129 -0.941 . . . . 0.0 112.329 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.519 ' HB3' HD13 ' A' ' 144' ' ' LEU . 92.9 m-85 -112.24 -5.64 14.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -162.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.556 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.04 -36.94 75.87 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 m -70.22 -5.74 29.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.522 ' HB2' HD12 ' A' ' 144' ' ' LEU . 45.3 mt-30 -110.64 12.91 22.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.007 0.432 . . . . 0.0 111.292 -178.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.463 ' O ' HG21 ' A' ' 37' ' ' VAL . . . 100.98 52.35 1.1 Allowed Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.786 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.747 ' HD1' HG22 ' A' ' 37' ' ' VAL . 43.3 t80 -131.12 134.34 46.47 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.618 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 10.6 tp10 -137.74 144.61 41.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.516 -177.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.417 HD11 ' CE3' ' A' ' 92' ' ' TRP . 60.3 mt -109.29 125.65 66.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.184 0.516 . . . . 0.0 110.426 177.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.486 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 85.6 t80 -111.0 102.02 10.53 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.54 -0.755 . . . . 0.0 108.974 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -95.31 134.45 38.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.252 -174.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.552 HD11 ' CE2' ' A' ' 42' ' ' PHE . 43.2 mt -120.11 112.16 35.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 0.0 110.059 174.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.427 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 30.1 t -91.11 140.66 29.61 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.7 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.621 HD13 HD12 ' A' ' 114' ' ' LEU . 16.6 mt -93.48 13.62 21.21 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 78' ' ' GLY . 5.2 p-10 44.13 -111.33 0.21 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.366 -1.288 . . . . 0.0 113.393 178.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.468 ' H ' ' CG ' ' A' ' 77' ' ' ASP . . . 92.75 -29.13 8.21 Favored Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 -170.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.73 119.51 11.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -72.58 -30.27 64.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.55 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -67.48 -57.07 7.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.391 -174.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -66.02 -38.31 88.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.397 -174.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.51 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 36.1 t90 -62.42 -48.11 81.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.658 ' HE2' HD11 ' A' ' 23' ' ' LEU . 3.2 ttmt -58.11 -54.89 41.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.488 -174.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -66.03 -33.74 76.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.916 -0.583 . . . . 0.0 112.194 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.52 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.2 t -83.38 -32.8 25.99 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.458 -177.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.451 ' CB ' ' HG ' ' A' ' 94' ' ' CYS . . . -75.82 -35.0 60.15 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.501 ' HB2' ' CD2' ' A' ' 23' ' ' LEU . 19.0 t70 -70.34 -28.46 65.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.035 -176.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -94.08 16.43 14.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.482 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.57 HD11 ' HB2' ' A' ' 94' ' ' CYS . 16.5 mt -88.71 148.32 41.42 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.36 0.6 . . . . 0.0 112.166 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.663 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.6 Cg_endo -76.04 -37.71 1.45 Allowed 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.693 2.929 . . . . 0.0 113.03 177.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.663 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 10.9 p90 -104.58 -167.91 1.41 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.778 -175.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.424 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 38.4 t -82.4 125.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.608 -175.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.57 ' HB2' HD11 ' A' ' 90' ' ' LEU . 30.8 t -121.91 108.78 13.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.241 0.543 . . . . 0.0 109.977 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.835 HG12 ' HB2' ' A' ' 20' ' ' LEU . 14.1 t -114.58 162.01 12.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.288 -172.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.416 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . 44.0 ttp180 -128.44 137.24 51.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 111.277 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -87.94 145.97 25.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.57 -24.64 45.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.089 0.471 . . . . 0.0 111.357 -176.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.54 32.18 5.7 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.917 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . -57.76 82.62 0.01 OUTLIER Glycine 0 C--N 1.342 0.876 0 O-C-N 123.757 0.66 . . . . 0.0 114.129 -173.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 167.24 -33.9 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.544 1.138 . . . . 0.0 108.561 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.92 12.07 5.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.97 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.543 ' HB3' HG13 ' A' ' 106' ' ' ILE . 41.9 t -62.99 135.85 57.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.604 -177.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.549 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.3 m -54.99 -37.24 66.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.13 -176.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -56.84 -56.48 21.07 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.301 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.543 HG13 ' HB3' ' A' ' 103' ' ' SER . 11.5 mt -58.61 -33.74 49.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.664 -175.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 18.6 m -71.01 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.427 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 104' ' ' SER . 94.6 mt -64.55 -34.96 79.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.751 0.31 . . . . 0.0 110.977 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.454 ' HH ' HD11 ' A' ' 18' ' ' ILE . 49.9 m-85 -77.69 -4.11 44.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.895 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 t30 . . . . . 0 C--O 1.233 0.221 0 CA-C-O 121.883 0.849 . . . . 0.0 109.728 -174.423 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.621 HD12 HD13 ' A' ' 76' ' ' LEU . 36.2 mt . . . . . 0 C--O 1.232 0.175 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.626 ' HA ' ' O ' ' A' ' 42' ' ' PHE . 43.6 Cg_endo -68.25 150.16 85.55 Favored 'Cis proline' 0 C--N 1.347 0.462 0 C-N-CA 123.84 -1.317 . . . . 0.0 114.234 1.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.1 m -136.44 164.35 28.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.207 174.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 p -133.7 152.45 34.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.048 0.452 . . . . 0.0 110.68 -176.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.456 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 71.5 m-85 -133.77 152.1 51.78 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.356 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.615 HD11 HD13 ' A' ' 136' ' ' LEU . 35.4 tp -111.85 142.98 43.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.123 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.671 ' CG2' ' HB ' ' A' ' 38' ' ' VAL . 4.6 m -136.56 146.3 28.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 169.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -83.38 171.91 13.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 8.9 ptp180 -65.16 -11.81 44.38 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -168.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -80.55 6.48 12.38 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 172.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.686 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 2.2 t-20 56.21 53.88 8.43 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.988 -173.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.442 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 75.1 mm-40 -129.98 143.95 51.07 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.625 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.636 ' HA ' HG11 ' A' ' 120' ' ' VAL . 2.6 tt -57.07 119.33 6.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.284 0.564 . . . . 0.0 110.954 -172.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.86 -51.84 5.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.161 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.51 171.56 7.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -176.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.577 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -99.09 163.83 12.41 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.638 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.407 ' HA2' HD11 ' A' ' 133' ' ' ILE . . . -44.42 -42.52 7.2 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 -175.134 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -41.42 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 117.27 0.535 . . . . 0.0 110.948 -177.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -63.48 -27.97 69.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.167 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ILE . . . . . 0.792 HG22 HD22 ' A' ' 136' ' ' LEU . 90.0 mt -68.24 -33.28 59.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.604 178.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.629 ' HB2' ' HZ1' ' A' ' 134' ' ' LYS . 5.1 mtmp? 72.09 -55.3 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.444 0.698 . . . . 0.0 110.263 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -154.47 124.68 6.84 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.508 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.792 HD22 HG22 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -66.98 -42.98 84.16 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.678 -173.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.535 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.0 t70 -52.14 -51.28 58.92 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.107 0.479 . . . . 0.0 109.961 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.28 -50.54 50.09 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.4 175.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -71.6 -46.81 58.14 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -173.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ILE . . . . . 0.846 HD13 HD12 ' A' ' 60' ' ' LEU . 36.4 mt -59.04 -36.52 62.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 0.0 110.379 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -59.35 -49.47 77.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.451 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -75.51 -21.53 57.92 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.711 -178.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' LEU . . . . . 0.542 HD11 HD21 ' A' ' 119' ' ' LEU . 86.2 mt -69.59 -40.36 76.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.333 0.587 . . . . 0.0 110.436 175.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.522 HD12 ' HB2' ' A' ' 67' ' ' GLN . 73.2 mt . . . . . 0 C--N 1.324 -0.5 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.253 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.3 tpp . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 120.584 0.23 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.2 t -171.59 156.18 4.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.4 tp -98.57 99.36 10.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.971 0.415 . . . . 0.0 110.306 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -117.53 154.41 31.53 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.756 HG22 ' HB3' ' A' ' 13' ' ' ALA . 60.8 mt -107.31 96.9 16.96 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 120.771 0.319 . . . . 0.0 110.987 -177.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -91.87 160.03 3.37 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.721 2.28 . . . . 0.0 111.791 176.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.877 ' HB3' ' HB3' ' A' ' 12' ' ' GLU . 12.0 pt-20 -159.03 163.77 36.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.578 -178.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.552 ' OD2' ' HG2' ' A' ' 9' ' ' LYS . 26.6 t70 173.31 -40.16 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 124.401 1.063 . . . . 0.0 109.854 175.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.552 ' HG2' ' OD2' ' A' ' 8' ' ' ASP . 42.9 mmtm -150.3 165.78 31.97 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.036 -1.438 . . . . 0.0 109.466 -175.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.0 mt 63.0 -90.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 O-C-N 123.8 0.687 . . . . 0.0 111.42 176.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.588 ' HG2' ' OE2' ' A' ' 12' ' ' GLU . 3.4 ttpp -153.28 148.0 26.31 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.688 177.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.877 ' HB3' ' HB3' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -77.92 151.23 33.86 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.601 177.177 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.756 ' HB3' HG22 ' A' ' 5' ' ' ILE . . . 53.59 41.73 32.03 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.252 0.549 . . . . 0.0 110.774 -178.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.08 -15.24 60.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.151 -175.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.9 tp -121.01 131.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.166 0.508 . . . . 0.0 111.122 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.512 ' O ' HD11 ' A' ' 30' ' ' LEU . 3.9 mp -95.95 122.81 47.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.555 175.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.4 ' OD1' ' HB2' ' A' ' 29' ' ' SER . 26.2 t70 -87.08 106.17 17.68 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.675 ' O ' ' HA ' ' A' ' 29' ' ' SER . 13.0 mt -89.4 110.2 21.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.457 -173.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.498 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 34.3 mt-30 -105.59 100.03 9.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.196 0.522 . . . . 0.0 110.776 -178.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' A' ' 97' ' ' ASP . 32.7 mt -140.22 151.01 44.84 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 174.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.654 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.9 mttm -90.89 155.34 18.82 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.037 -173.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.549 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 15.2 p30 -91.76 -172.6 3.26 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.03 -175.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.77 HD11 ' HA ' ' A' ' 84' ' ' LYS . 21.2 tp -57.31 -27.38 62.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.319 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 68.0 mttm -96.05 -12.5 24.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.062 0.458 . . . . 0.0 111.026 -175.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.91 -3.34 31.86 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.38 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.552 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 17.9 m-80 -72.26 118.76 15.55 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.654 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.6 m -73.08 106.21 4.85 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.209 -177.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.425 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 16.5 mmt180 -87.81 142.14 28.05 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.742 -177.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.675 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 31.9 p -135.33 159.76 40.55 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.817 ' HB3' HD22 ' A' ' 124' ' ' ASN . 47.0 mt -72.72 -21.35 61.05 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.446 0.641 . . . . 0.0 110.004 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.405 ' HA ' ' NZ ' ' A' ' 34' ' ' LYS . 3.6 p -73.17 -15.5 61.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.144 172.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t70 -87.37 -40.12 14.7 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.751 0.786 . . . . 0.0 109.467 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.702 HD23 HG13 ' A' ' 38' ' ' VAL . 7.8 tp -86.6 15.81 5.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.281 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.669 ' HZ1' ' HB2' ' A' ' 34' ' ' LYS . 4.4 ttmp? -66.76 -11.17 53.76 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.332 0.587 . . . . 0.0 111.517 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.21 -20.58 71.32 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.625 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.663 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 76.7 mttt -129.95 178.8 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.777 HG21 ' HD1' ' A' ' 69' ' ' PHE . 19.6 m -81.02 129.0 38.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 166.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.702 HG13 HD23 ' A' ' 33' ' ' LEU . 24.1 t -101.68 121.62 52.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.123 0.487 . . . . 0.0 111.868 -168.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.5 tp -88.41 116.18 26.46 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.366 173.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.537 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 10.0 mm -90.08 105.25 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.48 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 10.3 t70 -106.99 130.3 54.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.922 0.391 . . . . 0.0 110.902 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.68 ' HB3' HD12 ' A' ' 76' ' ' LEU . 66.5 m-85 -121.3 100.74 7.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.839 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 t -146.64 176.39 9.87 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.625 -178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.473 HG23 ' HB2' ' A' ' 47' ' ' ASN . 5.2 m -111.06 119.49 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.135 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.711 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 43.8 m-85 -74.42 83.52 1.96 Allowed 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 173.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 177.45 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.933 0.873 . . . . 0.0 109.791 -168.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.473 ' HB2' HG23 ' A' ' 44' ' ' VAL . 9.0 t-20 -95.04 142.52 27.42 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.06 -1.427 . . . . 0.0 110.837 -167.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -29.53 66.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.437 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.9 ptp -65.98 -22.08 66.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.011 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 t -73.33 -29.73 62.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.54 -52.17 62.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.119 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.26 -37.0 80.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.746 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.464 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 78.6 t60 -64.84 -36.79 85.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.394 178.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.532 ' HA ' HD12 ' A' ' 57' ' ' LEU . 21.5 t-20 -67.17 -32.14 73.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.751 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tt -65.45 -42.74 92.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.972 0.415 . . . . 0.0 109.925 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.87 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.298 0.57 . . . . 0.0 110.368 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 54' ' ' ASN . 62.7 mt -69.03 -40.46 78.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.757 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -60.48 -30.12 69.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.192 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -76.4 -52.03 10.69 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.842 HD12 HD13 ' A' ' 140' ' ' ILE . 2.2 mm? -57.43 -27.84 62.76 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 112.681 -2.054 . . . . 0.0 111.415 178.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -76.29 -46.57 27.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.007 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.4 -22.18 65.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.247 0.546 . . . . 0.0 110.547 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.528 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 37.3 mttm -77.39 -61.16 2.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.035 -179.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.44 ' CZ ' ' HB2' ' A' ' 141' ' ' LYS . 95.8 m-85 -115.17 -8.05 12.4 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -164.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.547 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.89 -36.05 76.14 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.176 0.444 . . . . 0.0 111.491 -176.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.0 m -64.43 -19.99 65.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.646 -178.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -102.98 2.39 34.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.678 0.275 . . . . 0.0 111.267 -176.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 112.54 55.58 0.46 Allowed Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.567 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.777 ' HD1' HG21 ' A' ' 37' ' ' VAL . 31.4 t80 -131.54 143.33 50.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.663 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.75 148.24 38.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.976 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.526 HD11 ' CE3' ' A' ' 92' ' ' TRP . 56.9 mt -107.69 117.86 54.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.144 0.497 . . . . 0.0 110.066 176.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -99.32 99.32 10.25 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.48 ' HG3' ' HB3' ' A' ' 41' ' ' ASP . 43.9 tt0 -102.45 123.77 46.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.14 -172.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 49.6 mt -105.69 125.24 61.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.612 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.711 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 4.0 p -84.95 121.91 28.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.786 176.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.68 HD12 ' HB3' ' A' ' 42' ' ' PHE . 16.8 mt -106.52 5.74 29.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.284 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.488 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.1 p-10 -68.81 -60.93 2.04 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.162 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.55 32.73 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -178.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.476 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 33.8 t70 -113.16 104.18 12.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.375 0.607 . . . . 0.0 110.728 -178.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.476 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 31.0 mt-10 -68.78 -14.35 62.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.934 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . 0.476 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 61.0 m80 -66.49 -59.35 3.73 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.624 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -74.43 -34.46 63.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.276 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -60.8 -53.38 58.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.955 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.77 ' HA ' HD11 ' A' ' 23' ' ' LEU . 19.3 ttmt -63.87 -41.62 97.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.689 0.281 . . . . 0.0 111.391 -173.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -69.75 -41.46 75.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.84 0.353 . . . . 0.0 111.548 -177.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -75.54 -47.56 26.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.369 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.643 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -67.79 -27.16 66.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.833 -174.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -58.54 -27.26 64.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.25 0.548 . . . . 0.0 111.429 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -108.67 13.0 25.44 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.773 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.7 mt -90.37 144.69 31.27 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 111.718 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.59 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 60.5 Cg_endo -70.25 -52.81 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.688 2.925 . . . . 0.0 113.518 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.59 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.8 p90 -87.41 -169.02 2.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.144 -171.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.8 t -80.96 126.83 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.849 -173.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.643 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 2.0 p -123.73 108.65 12.76 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.508 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.548 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 19.7 m -121.43 172.17 8.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.233 -178.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -125.57 144.36 50.6 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.984 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.493 ' HA ' HD11 ' A' ' 20' ' ' LEU . 19.8 t70 -81.6 168.74 17.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.903 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.28 -38.33 27.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.252 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.408 ' CG ' ' HB2' ' A' ' 102' ' ' TYR . 7.3 t-20 -122.97 -11.77 8.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.008 0.432 . . . . 0.0 111.339 -175.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.535 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 78.64 -108.91 2.74 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.472 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.01 -23.94 64.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.079 0.466 . . . . 0.0 110.858 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.408 ' HB2' ' CG ' ' A' ' 99' ' ' ASN . 55.6 m-85 -99.08 29.16 4.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.804 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.501 ' HB3' HG13 ' A' ' 106' ' ' ILE . 37.1 t -60.15 140.0 57.19 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.507 -178.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.55 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.5 m -63.36 -31.26 72.37 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.745 174.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -67.19 -48.82 66.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.995 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.916 HG23 HG11 ' A' ' 111' ' ' VAL . 58.9 mt -53.71 -38.03 33.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.623 175.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 20.4 m -68.61 -39.56 80.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.742 177.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.8 mt -68.59 -38.72 80.9 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.62 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.53 ' OH ' HD12 ' A' ' 18' ' ' ILE . 89.1 m-85 -69.8 -30.56 68.13 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.818 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.35 45.82 4.74 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -165.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.916 HG11 HG23 ' A' ' 106' ' ' ILE . 1.5 p -79.85 -46.62 22.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.27 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 30.7 m 71.77 -53.72 0.68 Allowed 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 170.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.468 ' C ' HD21 ' A' ' 113' ' ' ASN . 0.2 OUTLIER -67.24 -80.04 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 -170.803 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.486 HD23 HG23 ' A' ' 111' ' ' VAL . 3.6 mm? 67.41 143.19 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.043 0.537 . . . . 0.0 111.708 -176.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.46 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 52.7 Cg_endo -70.56 162.09 87.1 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.239 -1.567 . . . . 0.0 111.716 -0.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.6 t -147.89 176.66 9.97 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.221 0.534 . . . . 0.0 110.748 -176.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.494 HG11 ' HA3' ' A' ' 130' ' ' GLY . 2.8 p -142.82 154.7 17.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 175.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.537 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.3 m-85 -143.3 158.17 43.86 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.948 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.5 tp -112.33 143.87 42.7 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.64 -173.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 2.8 t -140.95 131.69 27.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.035 172.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.564 ' HB3' HD22 ' A' ' 143' ' ' LEU . 3.9 p-10 -96.62 176.98 5.81 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.366 176.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.442 ' C ' ' H ' ' A' ' 124' ' ' ASN . 84.0 mtt-85 -43.33 -42.56 4.59 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -166.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.537 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 75.3 m-20 -78.95 12.73 2.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 121.995 -0.441 . . . . 0.0 110.457 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.817 HD22 ' HB3' ' A' ' 30' ' ' LEU . 2.3 t-20 61.18 44.12 10.32 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.487 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.537 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 87.4 mt-10 -96.23 133.13 40.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.288 177.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.7 tt -72.34 107.94 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.948 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 63.8 m -71.66 -55.49 7.62 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.291 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 178.95 173.04 0.77 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.037 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.559 ' HD3' ' OE2' ' A' ' 131' ' ' GLU . 76.4 mtt180 -83.3 159.28 21.93 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.745 176.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.494 ' HA3' HG11 ' A' ' 117' ' ' VAL . . . -62.81 -34.33 89.47 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 111.747 -0.541 . . . . 0.0 111.747 175.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.559 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 2.0 mp0 -64.19 -25.39 68.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.248 0.547 . . . . 0.0 110.356 177.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -90.69 -26.86 19.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.315 0.579 . . . . 0.0 110.194 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.577 ' CD1' ' HB2' ' A' ' 119' ' ' LEU . 23.4 mt -99.11 94.79 3.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.147 -175.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.17 11.71 24.67 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.227 173.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -143.43 41.4 1.47 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.283 -170.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.55 ' O ' HG13 ' A' ' 140' ' ' ILE . 3.7 mp -53.66 -35.37 60.95 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -176.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.6 ' HA ' HD11 ' A' ' 60' ' ' LEU . 24.0 t70 -54.53 -58.41 7.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.738 0.304 . . . . 0.0 110.551 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.605 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 4.4 mm-40 -65.68 -32.61 74.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 111.916 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.705 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.68 -56.01 24.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.618 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.842 HD13 HD12 ' A' ' 60' ' ' LEU . 48.2 mt -61.47 -34.98 63.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.143 0.497 . . . . 0.0 110.108 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 64' ' ' TYR . 25.6 tttm -60.0 -53.41 58.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.896 176.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' A' ' 138' ' ' GLU . 13.8 pttm -67.27 -27.34 67.12 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.705 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 48.3 mt -64.22 -42.12 96.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.669 0.747 . . . . 0.0 110.027 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.425 HD21 ' NH2' ' A' ' 122' ' ' ARG . 88.0 mt -71.02 -32.73 69.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.987 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.493 ' HB3' ' NE2' ' A' ' 148' ' ' HIS . 29.8 mt-10 -62.25 -6.83 3.44 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -57.49 -17.82 27.54 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 120.388 -0.911 . . . . 0.0 111.985 173.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -64.17 -28.12 69.54 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . 0.493 ' NE2' ' HB3' ' A' ' 145' ' ' GLU . 14.7 p80 -89.7 57.94 4.09 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.507 -178.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 37.9 m80 52.43 58.83 4.98 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.77 175.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.5 ' HB3' ' H ' ' A' ' 152' ' ' HIS . 0.0 OUTLIER -175.98 -164.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 -176.343 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.459 ' O ' ' HB3' ' A' ' 152' ' ' HIS . 3.1 t60 -111.19 -3.86 15.23 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 169.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . 0.5 ' H ' ' HB3' ' A' ' 150' ' ' HIS . 26.3 p80 . . . . . 0 C--O 1.249 1.076 0 CA-C-N 113.874 -1.512 . . . . 0.0 107.769 173.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.5 ' H2 ' ' CD ' ' A' ' 4' ' ' GLU . 27.8 ttt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.717 0.294 . . . . 0.0 110.244 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.1 m -151.96 -67.42 0.17 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.9 tp -153.46 68.06 0.78 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.418 0.628 . . . . 0.0 109.815 177.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.5 ' CD ' ' H2 ' ' A' ' 1' ' ' MET . 2.3 pm0 -90.58 143.02 27.15 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.925 175.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.44 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 58.2 mt -99.0 113.14 64.34 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.423 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.531 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 6.9 Cg_exo -76.86 -131.91 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 123.713 2.942 . . . . 0.0 112.696 179.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.442 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 35.0 mt-10 -48.69 136.64 13.18 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.658 -0.701 . . . . 0.0 112.128 -179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -82.16 75.23 9.1 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 171.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.932 ' HB3' ' HZ3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER 175.61 125.09 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.998 -1.001 . . . . 0.0 108.684 -176.644 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.586 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 43.3 mm -49.99 103.99 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 O-C-N 123.828 0.705 . . . . 0.0 111.984 -176.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.586 ' HB2' ' O ' ' A' ' 10' ' ' ILE . 9.1 ttpp 153.84 4.7 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.124 1.37 . . . . 0.0 108.617 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -74.55 -25.02 59.03 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.531 -172.924 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.74 2.17 10.68 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.801 -176.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.7 m -147.13 76.24 1.41 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.783 0.325 . . . . 0.0 111.67 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.501 HG23 ' O ' ' A' ' 124' ' ' ASN . 9.4 pt 42.5 -159.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 124.74 1.275 . . . . 0.0 113.392 172.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.546 ' O ' HD13 ' A' ' 30' ' ' LEU . 79.5 mt -121.66 103.52 13.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 174.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -104.23 130.81 52.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.516 HG22 ' HG ' ' A' ' 20' ' ' LEU . 14.6 mt -116.76 121.47 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.228 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.515 ' HG3' ' HB3' ' A' ' 29' ' ' SER . 1.7 mp0 -98.08 101.75 13.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.732 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.516 ' HG ' HG22 ' A' ' 18' ' ' ILE . 33.7 mt -132.03 155.6 47.74 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 50.7 mttm -86.94 151.07 23.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.934 0.397 . . . . 0.0 110.793 178.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.627 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -85.39 -177.53 6.49 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.404 175.075 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.651 ' CD2' ' HA ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -53.89 -36.73 63.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.546 0.689 . . . . 0.0 112.005 179.346 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.5 mttp -78.22 -18.91 54.8 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.718 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 107.69 9.28 28.97 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.474 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.404 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 42.5 m-80 -81.57 108.86 15.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.479 0.18 . . . . 0.0 110.899 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.579 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 62.6 m -68.32 110.22 3.98 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.452 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 5.8 mmm180 -104.38 130.71 52.23 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.991 0.424 . . . . 0.0 110.329 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.515 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 45.7 p -104.31 159.04 16.04 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 169.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.546 HD13 ' O ' ' A' ' 16' ' ' ILE . 50.7 mt -69.6 -26.0 64.24 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.487 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.4 p -68.55 -16.29 63.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.73 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -78.55 -24.83 45.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 122.295 1.045 . . . . 0.0 108.913 176.788 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.589 HD22 HG13 ' A' ' 38' ' ' VAL . 1.5 tp -99.18 6.08 46.54 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.133 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.525 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 51.0 tttm -69.77 144.53 52.67 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -176.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.73 -21.46 43.79 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 1.132 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 10.0 ttmt -124.07 155.8 37.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.425 -0.887 . . . . 0.0 108.859 178.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.76 HG21 ' HD1' ' A' ' 69' ' ' PHE . 26.9 m -81.59 140.3 16.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -176.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.589 HG13 HD22 ' A' ' 33' ' ' LEU . 32.2 t -122.56 129.02 75.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.27 0.557 . . . . 0.0 111.9 -169.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.598 HD22 HG22 ' A' ' 71' ' ' ILE . 7.0 tt -91.65 112.62 24.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.035 172.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.565 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 15.7 mm -91.03 105.75 16.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.235 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -109.67 139.77 44.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.987 0.423 . . . . 0.0 111.244 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.5 102.43 7.38 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.474 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.9 t -139.63 164.33 30.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.989 0.423 . . . . 0.0 111.62 -174.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.643 HG13 ' HA ' ' A' ' 77' ' ' ASP . 3.3 m -106.47 126.68 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.243 176.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.57 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 21.5 m-85 -87.8 83.42 7.13 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 -177.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.52 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 3.9 m-20 177.14 -50.03 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 114.666 -1.152 . . . . 0.0 108.585 -177.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.55 ' HB3' HG21 ' A' ' 44' ' ' VAL . 3.1 t30 -70.26 133.13 46.71 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.285 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.88 -24.63 38.29 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.557 -173.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.6 mtt -59.76 -26.69 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.851 177.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -75.8 -40.97 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.432 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.47 -59.25 5.26 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.771 -175.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.89 71.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.707 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.484 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 t60 -65.19 -45.37 85.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.793 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.499 ' HA ' HD12 ' A' ' 57' ' ' LEU . 89.5 m-20 -69.07 -25.21 64.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.154 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.6 tt -73.09 -44.9 59.79 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.52 -35.34 74.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.36 0.6 . . . . 0.0 110.03 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.499 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -67.07 -37.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.867 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.409 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 10.1 tpp180 -60.95 -28.31 68.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.497 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -77.99 -53.75 7.07 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 122.666 1.222 . . . . 0.0 107.879 -177.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.758 HD11 HD12 ' A' ' 140' ' ' ILE . 2.4 mm? -55.36 -29.1 57.74 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 112.282 -2.235 . . . . 0.0 111.506 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -75.54 -48.29 23.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.912 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -61.71 -21.89 64.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.251 0.548 . . . . 0.0 110.431 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -80.35 -57.57 3.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.319 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -108.17 -5.59 16.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -167.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -70.63 178.69 2.9 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.867 178.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.5 m 71.61 -35.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.326 0.65 . . . . 0.0 111.602 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.455 ' H ' ' C ' ' A' ' 65' ' ' ALA . 50.6 mt-30 -79.45 -0.49 33.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 111.114 178.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.575 ' O ' HG23 ' A' ' 37' ' ' VAL . . . 110.71 47.53 0.78 Allowed Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.907 -0.664 . . . . 0.0 111.896 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.76 ' HD1' HG21 ' A' ' 37' ' ' VAL . 65.4 t80 -129.57 141.2 51.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.55 0.214 . . . . 0.0 110.872 -179.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 1.132 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.1 tp10 -137.38 153.32 50.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.14 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.598 HG22 HD22 ' A' ' 39' ' ' LEU . 47.8 mt -111.9 124.77 68.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 173.026 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.452 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.1 t80 -109.69 100.92 9.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.204 0.526 . . . . 0.0 109.884 -177.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.704 ' HB2' ' HA ' ' A' ' 94' ' ' CYS . 15.9 mm100 -83.33 125.97 32.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.263 -178.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.8 mt -111.71 111.1 34.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 43' ' ' THR . 53.5 p -92.62 115.03 27.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.98 0.419 . . . . 0.0 110.815 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.704 HD12 HD22 ' A' ' 114' ' ' LEU . 0.5 OUTLIER -109.21 29.05 7.88 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.099 0.476 . . . . 0.0 110.106 177.507 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.643 ' HA ' HG13 ' A' ' 44' ' ' VAL . 16.8 t70 -73.41 -77.67 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.572 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.17 -31.13 2.38 Favored Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.872 -178.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -81.61 135.97 35.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.165 0.507 . . . . 0.0 111.763 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -79.34 -52.14 8.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.963 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -66.71 -29.7 69.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -165.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -88.63 -40.05 13.61 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.474 ' CZ2' ' HG ' ' A' ' 23' ' ' LEU . 28.5 t90 -57.51 -47.62 81.46 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.326 172.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.651 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 14.2 mtpp -65.66 -47.71 74.61 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -176.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.5 p -63.92 -38.52 91.38 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.318 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.438 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 16.8 m -78.71 -42.72 27.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.135 -177.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.567 ' HB1' HD23 ' A' ' 23' ' ' LEU . . . -88.53 -33.46 17.74 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -169.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.506 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 2.0 t0 -73.43 -12.19 60.72 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 110.017 -174.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -101.99 13.49 34.61 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.011 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.47 HD12 ' HA ' ' A' ' 87' ' ' ALA . 53.6 mt -96.69 150.33 36.84 Favored Pre-proline 0 N--CA 1.447 -0.592 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.525 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.692 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.2 Cg_endo -74.02 -42.39 0.77 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.991 3.127 . . . . 0.0 113.125 -177.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.692 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.7 p90 -90.15 -167.43 1.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.37 -171.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.0 t -81.69 130.79 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.158 -174.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.704 ' HA ' ' HB2' ' A' ' 73' ' ' GLN . 53.1 m -133.52 102.13 5.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.889 0.376 . . . . 0.0 110.233 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.627 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.0 m -114.15 173.25 3.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.761 -175.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -124.34 136.19 53.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.785 0.326 . . . . 0.0 111.611 -177.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -72.35 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.396 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.32 -25.46 33.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.1 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -97.75 -12.33 22.39 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.861 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 61.78 66.07 2.85 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.616 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.456 ' HB3' HD13 ' A' ' 76' ' ' LEU . . . 77.81 -16.11 0.69 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.397 0.679 . . . . 0.0 111.749 177.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -92.05 19.47 6.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.208 0.528 . . . . 0.0 109.712 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.513 ' HB3' HG13 ' A' ' 106' ' ' ILE . 9.2 t -72.81 129.76 38.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.123 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 3.8 p -62.09 -30.88 71.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.458 -177.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.464 ' HA ' HD13 ' A' ' 108' ' ' LEU . 55.6 m-85 -61.55 -34.54 75.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.518 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.514 HG22 HG13 ' A' ' 111' ' ' VAL . 65.6 mt -58.92 -39.28 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.0 0.429 . . . . 0.0 110.478 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.3 m -74.36 -29.06 61.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 177.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 105' ' ' TYR . 94.9 mt -70.57 -25.35 63.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.209 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.45 ' HB3' ' CE2' ' A' ' 118' ' ' PHE . 68.4 m-85 -77.54 -12.81 60.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.23 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.412 HD21 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER 60.08 55.48 3.71 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -171.749 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.514 HG13 HG22 ' A' ' 106' ' ' ILE . 14.2 p -71.89 134.38 30.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.578 -178.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 6.1 m -98.59 -31.81 11.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.057 0.456 . . . . 0.0 110.983 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' A' ' 116' ' ' SER . 36.1 t-20 -152.7 142.07 21.61 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 -178.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.704 HD22 HD12 ' A' ' 76' ' ' LEU . 2.4 tt -144.43 145.26 28.28 Favored Pre-proline 0 CA--C 1.538 0.499 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -178.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.685 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 44.3 Cg_exo -51.22 144.04 8.78 Favored 'Cis proline' 0 C--N 1.362 1.261 0 CA-C-N 120.022 1.043 . . . . 0.0 114.079 2.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.469 ' HB2' ' O ' ' A' ' 113' ' ' ASN . 4.9 t -139.05 175.33 9.65 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.799 -173.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.649 HG13 HD12 ' A' ' 136' ' ' LEU . 9.3 p -142.32 152.54 18.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.822 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.62 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 84.1 m-85 -137.81 161.31 36.91 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.995 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.5 tp -110.9 136.76 49.45 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.802 -174.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.461 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 2.9 t -137.85 122.95 24.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 172.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.58 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 10.3 p30 -87.57 176.07 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 119.963 -0.695 . . . . 0.0 109.728 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.558 ' NH2' ' HA ' ' A' ' 147' ' ' HIS . 22.9 ptt-85 -64.12 -9.79 18.69 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -165.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.544 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 66.4 t30 -88.36 7.32 33.09 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.452 -0.78 . . . . 0.0 109.518 174.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.525 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 0.1 OUTLIER 74.83 24.45 1.6 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.914 -178.176 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.58 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 84.7 mt-10 -91.45 116.05 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.576 -172.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 119' ' ' LEU . 1.6 tm? -59.56 107.66 0.62 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.584 0.707 . . . . 0.0 109.228 174.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.995 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.4 m -80.99 -56.62 3.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.41 -173.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.25 18.82 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.62 ' HG3' ' CE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -104.26 167.49 9.72 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.963 178.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.09 51.17 Favored Glycine 0 CA--C 1.52 0.395 0 N-CA-C 114.546 0.579 . . . . 0.0 114.546 -174.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -21.7 46.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.286 0.543 . . . . 0.0 110.328 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.402 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -71.5 -36.17 71.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.693 173.772 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.525 HD13 ' HB2' ' A' ' 119' ' ' LEU . 96.3 mt -69.53 129.86 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.831 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.99 95.61 5.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 11.3 t0 69.22 117.53 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 O-C-N 124.175 0.922 . . . . 0.0 111.185 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.649 HD12 HG13 ' A' ' 117' ' ' VAL . 14.9 mt -75.83 -25.76 56.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.443 -177.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.617 ' HA ' HD13 ' A' ' 60' ' ' LEU . 11.5 t70 -60.73 -41.1 94.65 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.415 ' HB3' ' HZ2' ' A' ' 142' ' ' LYS . 4.1 mm-40 -70.8 -36.38 72.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.672 172.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.457 ' HB2' ' HA ' ' A' ' 136' ' ' LEU . . . -65.37 -53.35 44.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.921 0.391 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.758 HD12 HD11 ' A' ' 60' ' ' LEU . 55.6 mt -60.34 -40.91 85.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.145 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.692 ' O ' ' HG2' ' A' ' 145' ' ' GLU . 64.6 tttp -58.35 -48.75 79.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.415 ' HZ2' ' HB3' ' A' ' 138' ' ' GLU . 18.3 mtmm -66.32 -20.04 65.98 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.961 -179.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.697 HD23 ' HG ' ' A' ' 119' ' ' LEU . 66.7 mt -66.83 -39.85 87.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.413 0.625 . . . . 0.0 109.866 172.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.495 ' HA ' HH12 ' A' ' 122' ' ' ARG . 96.2 mt -76.5 -47.32 23.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.737 177.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.692 ' HG2' ' O ' ' A' ' 141' ' ' LYS . 3.5 mm-40 -70.19 -20.7 63.1 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.984 -176.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -72.7 55.81 1.69 Allowed Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . 0.558 ' HA ' ' NH2' ' A' ' 122' ' ' ARG . 1.1 p-80 -74.46 72.71 1.88 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.187 -0.506 . . . . 0.0 111.926 -176.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 29.1 p80 -90.64 5.66 47.1 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.35 145.21 0.17 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.345 -1.298 . . . . 0.0 108.145 173.207 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 67.47 111.7 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 O-C-N 123.644 0.59 . . . . 0.0 109.851 -173.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 48.2 t60 -61.23 135.64 57.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.384 0.611 . . . . 0.0 111.895 -175.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 . . . . . 0 C--O 1.245 0.855 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 164.411 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.41 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.669 0.271 . . . . 0.0 110.651 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -65.99 131.73 46.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.453 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.5 tp -145.21 129.88 18.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.165 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -93.84 139.6 30.68 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.8 mt -129.73 97.93 23.24 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.874 0.369 . . . . 0.0 110.427 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -87.9 -166.12 0.26 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.556 2.838 . . . . 0.0 113.132 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -61.56 -54.81 38.12 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.963 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -81.79 176.01 9.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.959 -177.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 32.2 mmtm -125.62 -154.72 0.64 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.385 -177.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.5 mm 63.78 -77.43 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.52 -0.208 0 CA-C-O 121.281 0.563 . . . . 0.0 110.947 -171.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.635 ' HD2' ' O ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -158.45 -14.29 0.07 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.736 175.363 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -81.75 178.93 8.04 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.526 -167.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.05 26.2 16.16 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.273 -167.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.93 -11.35 5.44 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.124 -176.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.669 HD13 HD11 ' A' ' 30' ' ' LEU . 15.3 tt -161.85 144.58 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.194 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.554 ' O ' HD13 ' A' ' 30' ' ' LEU . 4.0 mp -87.65 112.66 23.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.3 108.56 4.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.175 0.512 . . . . 0.0 109.868 -177.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.5 mt -101.43 114.93 42.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.043 -178.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.545 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 79.2 mt-30 -105.58 101.11 10.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.869 -178.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.5 mt -132.22 158.28 42.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.193 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 26' ' ' ASN . 54.1 mttm -88.73 145.59 25.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.884 0.373 . . . . 0.0 111.536 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.552 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 25.9 m-20 -69.06 -177.0 0.96 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.263 174.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.662 HD12 ' HZ2' ' A' ' 84' ' ' LYS . 3.5 pp -61.7 -28.48 69.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.972 0.891 . . . . 0.0 109.14 168.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.841 ' HZ2' ' HB3' ' A' ' 24' ' ' LYS . 9.2 mtpm? -79.0 -7.18 57.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.024 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.434 ' HA2' ' HB3' ' A' ' 21' ' ' LYS . . . 81.93 16.04 73.53 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.947 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.552 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 11.6 m-20 -80.91 108.45 14.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.434 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.2 m -68.48 107.56 2.95 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.613 175.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -100.76 131.21 46.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.145 -178.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.545 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 24.5 p -102.36 161.66 13.53 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 170.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.669 HD11 HD13 ' A' ' 15' ' ' ILE . 51.1 mt -80.29 -29.02 38.17 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.556 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 p -67.5 -8.34 32.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.392 175.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -90.29 -45.14 9.24 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.453 ' CD1' ' HG2' ' A' ' 70' ' ' GLU . 1.4 mm? -67.5 -11.87 58.98 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 113.89 -1.505 . . . . 0.0 111.364 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 124' ' ' ASN . 8.7 ttpp -57.26 101.74 0.07 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.024 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 162.81 -39.95 0.35 Allowed Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.806 -1.317 . . . . 0.0 109.806 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.673 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 98.9 mttt -100.95 174.01 6.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 171.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.572 HG11 ' HD1' ' A' ' 69' ' ' PHE . 3.4 p -83.43 118.64 31.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 167.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.22 124.58 55.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.289 -167.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.472 HD13 ' CD2' ' A' ' 136' ' ' LEU . 12.2 tp -93.04 107.58 19.34 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.205 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.575 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.8 mm -84.73 106.54 14.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.553 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 28.8 t0 -101.62 129.8 47.82 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.883 -177.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -120.97 97.93 5.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.022 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.409 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -148.95 164.8 33.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.013 0.435 . . . . 0.0 111.573 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.404 HG12 ' O ' ' A' ' 76' ' ' LEU . 5.1 m -97.3 144.77 10.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.872 178.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.605 ' H ' ' HB3' ' A' ' 77' ' ' ASP . 7.3 m-85 -105.98 78.44 1.32 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.602 0.715 . . . . 0.0 110.436 172.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -163.15 16.82 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -144.48 131.88 20.85 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.171 -158.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.02 72.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.061 -175.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.14 -24.76 68.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 0.0 110.973 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.3 m -74.76 -27.3 60.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.094 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.52 -38.3 68.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.153 0.501 . . . . 0.0 110.231 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.07 -25.89 61.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.527 0.679 . . . . 0.0 109.802 174.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.522 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.7 t60 -75.32 -47.55 27.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.197 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.648 ' HA ' HD13 ' A' ' 57' ' ' LEU . 33.7 p30 -73.76 -21.28 60.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.86 0.362 . . . . 0.0 110.889 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.31 -57.49 12.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.804 172.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.07 75.13 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.664 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.648 HD13 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -63.21 -41.25 99.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.935 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -63.25 -31.43 72.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.329 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -74.48 -55.11 6.32 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 122.789 1.281 . . . . 0.0 108.041 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.704 HD11 HD13 ' A' ' 140' ' ' ILE . 2.0 mm? -55.0 -30.89 60.46 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.565 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -76.93 -46.25 24.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -62.61 -22.13 66.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.802 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -77.98 -61.61 1.94 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.194 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.568 ' OH ' ' HE3' ' A' ' 141' ' ' LYS . 96.3 m-85 -108.57 -1.43 19.65 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -164.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.444 ' C ' ' H ' ' A' ' 67' ' ' GLN . . . -68.01 170.22 8.7 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.438 176.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.2 m 71.5 -38.43 0.42 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.119 0.567 . . . . 0.0 111.08 -174.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 65' ' ' ALA . 61.1 mt-30 -71.01 -9.81 58.66 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.457 0.646 . . . . 0.0 110.514 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.421 ' O ' HG13 ' A' ' 37' ' ' VAL . . . 117.7 34.36 1.18 Allowed Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.201 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.572 ' HD1' HG11 ' A' ' 37' ' ' VAL . 82.0 t80 -112.36 142.11 45.28 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 177.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.673 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.2 tp10 -143.17 155.34 44.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 178.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.5 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 54.7 mt -123.11 126.16 73.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.176 0.513 . . . . 0.0 109.993 175.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.536 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 78.6 t80 -112.08 100.87 9.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.553 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 31.2 tt0 -98.28 129.21 44.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.679 -175.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 57.2 mt -109.31 120.1 59.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.847 175.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 89.7 p -89.48 125.81 35.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.48 0.657 . . . . 0.0 110.336 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.404 ' O ' HG12 ' A' ' 44' ' ' VAL . 14.3 mt -102.46 32.81 3.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 175.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.605 ' HB3' ' H ' ' A' ' 45' ' ' TYR . 4.6 p-10 -73.03 177.98 4.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.393 -168.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.89 26.03 4.57 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.011 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -162.89 109.36 1.19 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.467 ' HB2' HH12 ' A' ' 96' ' ' ARG . 35.1 tt0 -58.84 -40.97 85.8 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.706 -176.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -48.6 80.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.628 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -63.28 -47.85 80.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.859 0.362 . . . . 0.0 110.251 -175.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 21.5 t90 -61.1 -52.28 65.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.462 175.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.662 ' HZ2' HD12 ' A' ' 23' ' ' LEU . 26.3 tptp -52.57 -60.26 3.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.188 -177.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.8 m -60.06 -31.53 70.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.98 -173.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.0 t -85.32 -30.71 23.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 0.0 111.533 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.548 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.9 -18.76 26.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.328 0.585 . . . . 0.0 110.617 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.402 ' OD2' ' HG3' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -65.23 -8.14 16.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.414 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -116.37 16.34 15.72 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.497 0.665 . . . . 0.0 110.206 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.548 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 37.1 mt -87.04 141.28 33.02 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 121.495 0.664 . . . . 0.0 111.575 -178.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.674 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 68.7 Cg_endo -80.22 -30.13 2.23 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 123.919 3.079 . . . . 0.0 112.956 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.674 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.2 p90 -102.16 -169.28 1.65 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.258 -172.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.536 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 44.9 t -77.79 133.17 31.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.882 -176.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.515 ' SG ' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -140.63 95.48 2.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.431 0.634 . . . . 0.0 110.399 -176.12 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.462 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 18.0 m -113.79 170.27 4.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.158 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.467 HH12 ' HB2' ' A' ' 80' ' ' GLU . 38.0 ttp180 -126.19 138.31 53.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.599 0.238 . . . . 0.0 111.039 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -81.1 157.59 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.027 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.56 -23.3 37.27 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -175.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.59 -11.71 8.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.646 0.26 . . . . 0.0 111.642 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 71.23 -121.1 8.85 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.606 -0.806 . . . . 0.0 111.853 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.26 -14.93 62.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.984 0.421 . . . . 0.0 110.928 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -95.88 12.25 30.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.566 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.493 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.2 t -65.97 141.59 58.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.78 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.8 m -69.82 -24.03 63.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.202 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -59.56 -47.66 84.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 178.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.589 HG21 HG11 ' A' ' 111' ' ' VAL . 32.5 mt -57.99 -36.67 57.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.281 -176.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.8 m -68.93 -27.22 65.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.283 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.5 -27.15 64.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.753 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -87.17 1.53 52.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.64 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 48.13 29.03 1.68 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.74 0.816 . . . . 0.0 111.182 -177.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.589 HG11 HG21 ' A' ' 106' ' ' ILE . 11.2 p -43.42 135.47 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.982 -171.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 20.0 p -88.96 -28.98 19.88 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.62 177.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -162.38 146.99 12.23 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.756 0.313 . . . . 0.0 111.434 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.487 ' CD2' ' HB2' ' A' ' 116' ' ' SER . 27.7 mt -131.84 160.65 66.71 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 174.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.476 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 63.1 Cg_endo -71.7 156.09 97.46 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.853 -1.311 . . . . 0.0 113.017 0.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.487 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 5.9 m -146.16 173.74 11.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.263 -177.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.423 HG13 HD21 ' A' ' 136' ' ' LEU . 2.4 p -129.59 161.33 39.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.034 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.575 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.5 m-85 -137.6 157.78 45.78 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 174.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.87 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 6.8 tp -110.96 139.35 46.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -175.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.486 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.0 t -135.62 121.02 29.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.552 0.215 . . . . 0.0 110.964 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -76.39 164.15 26.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.466 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 34.1 mtt180 -52.3 -18.59 1.64 Allowed 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.155 0.91 . . . . 0.0 113.319 -169.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -84.74 6.25 25.08 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.519 ' HB2' ' HB2' ' A' ' 34' ' ' LYS . 1.6 t-20 63.0 52.23 2.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.538 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.486 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 49.5 mt-10 -127.22 143.57 51.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.422 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.0 tt -68.85 109.81 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.306 0.574 . . . . 0.0 110.176 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.87 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 58.1 m -76.82 -53.96 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.291 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -162.54 153.83 17.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 -177.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.588 ' O ' HG13 ' A' ' 133' ' ' ILE . 91.7 mtt180 -89.28 156.81 18.5 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.328 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.16 -26.14 60.9 Favored Glycine 0 C--O 1.225 -0.463 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -71.64 -11.78 61.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.443 0.639 . . . . 0.0 110.393 177.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -115.67 -37.22 4.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.069 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.753 HG22 ' HG ' ' A' ' 136' ' ' LEU . 42.7 mt -68.65 145.97 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -128.94 -43.02 1.36 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -130.78 111.92 12.58 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.552 173.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.753 ' HG ' HG22 ' A' ' 133' ' ' ILE . 5.8 mp -77.67 -30.48 52.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.963 -178.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -48.38 -57.83 5.49 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.609 0.568 . . . . 0.0 110.529 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.625 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 37.5 mm-40 -58.84 -43.02 90.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.935 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.423 ' HB3' HD22 ' A' ' 119' ' ' LEU . . . -60.76 -43.14 98.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.341 -175.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.704 HD13 HD11 ' A' ' 60' ' ' LEU . 40.7 mt -57.89 -44.43 86.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.717 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.579 ' HB2' ' O ' ' A' ' 138' ' ' GLU . 22.7 mttt -51.1 -55.42 17.78 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.447 0.642 . . . . 0.0 111.234 176.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.625 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 2.6 ptpt -74.2 -18.07 60.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.228 -0.897 . . . . 0.0 112.353 -173.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -83.71 -40.06 19.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.64 0.257 . . . . 0.0 111.245 173.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 71.8 mt -56.82 -49.84 74.19 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.8 175.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -72.28 -55.28 7.42 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.612 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.33 127.43 1.53 Allowed Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.676 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 70.5 t60 -75.88 67.53 2.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.294 0.569 . . . . 0.0 109.685 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -112.98 -54.41 2.63 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.359 -178.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -176.1 171.91 2.46 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 123.483 0.489 . . . . 0.0 110.031 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -68.16 99.86 0.95 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.117 0.484 . . . . 0.0 110.92 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -112.87 -0.61 14.84 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 . . . . . 0 C--O 1.25 1.096 0 CA-C-N 114.108 -1.405 . . . . 0.0 107.99 -174.617 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.2 ttt . . . . . 0 N--CA 1.483 1.216 0 CA-C-O 120.557 0.218 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.412 ' O ' ' HB ' ' A' ' 31' ' ' THR . 16.6 m -129.95 110.35 11.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.671 -0.241 . . . . 0.0 110.663 -177.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -85.5 105.25 15.97 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 177.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -85.85 142.81 28.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.867 -174.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.6 mt -128.38 95.73 32.46 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.31 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.538 ' HG2' ' HA ' ' A' ' 13' ' ' ALA . 6.1 Cg_exo -75.77 -164.84 0.26 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 123.236 2.624 . . . . 0.0 112.478 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.456 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 44.4 mt-10 -99.06 -169.9 1.84 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.382 0.61 . . . . 0.0 111.795 -175.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -90.76 10.18 27.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.239 174.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.456 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -91.82 -170.48 2.58 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.672 -176.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.0 mm -54.43 134.22 17.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.567 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.77 ' HB3' ' HA ' ' A' ' 14' ' ' SER . 90.5 mttt 63.06 71.91 0.5 Allowed 'General case' 0 N--CA 1.438 -1.063 0 O-C-N 123.79 0.681 . . . . 0.0 110.474 -171.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.439 ' CD ' ' H ' ' A' ' 12' ' ' GLU . 1.2 mp0 -65.2 -13.13 57.51 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.202 -176.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.538 ' HA ' ' HG2' ' A' ' 6' ' ' PRO . . . -129.07 -2.16 5.15 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.435 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.77 ' HA ' ' HB3' ' A' ' 11' ' ' LYS . 42.0 m 68.14 -53.15 0.53 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.704 0.801 . . . . 0.0 112.057 -177.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.638 HG23 ' O ' ' A' ' 124' ' ' ASN . 7.7 pt -132.32 -164.76 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 178.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.465 ' O ' HD11 ' A' ' 30' ' ' LEU . 89.0 mt -108.55 113.86 45.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 173.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -98.5 108.55 21.27 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 mt -94.4 121.43 45.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.714 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.56 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 32.3 mt-30 -119.04 100.77 7.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.49 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.1 mt -135.3 154.46 51.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 93.0 mttt -79.16 141.62 37.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.159 0.504 . . . . 0.0 110.894 -176.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.591 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 4.0 p-10 -88.45 -169.02 2.39 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.902 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.454 HD12 ' HB1' ' A' ' 87' ' ' ALA . 49.3 tp -52.99 -37.83 61.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.702 177.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -71.2 -27.79 63.75 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -177.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.26 18.52 14.61 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.504 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -108.27 127.9 54.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.599 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.7 m -63.12 110.6 1.89 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.383 0.611 . . . . 0.0 110.856 178.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.56 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 21.3 mmm180 -86.15 134.85 33.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.967 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.1 p -118.5 155.91 30.0 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 173.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.58 HD23 HG13 ' A' ' 38' ' ' VAL . 71.9 mt -73.29 -23.14 60.26 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.412 ' HB ' ' O ' ' A' ' 2' ' ' SER . 5.9 p -71.82 -0.92 12.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.72 175.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -98.11 -47.11 5.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.954 0.407 . . . . 0.0 110.882 178.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.706 ' HG ' HG21 ' A' ' 38' ' ' VAL . 0.6 OUTLIER -91.9 24.72 3.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.71 0.767 . . . . 0.0 109.41 175.334 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.596 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 59.4 tttp -55.92 -42.95 76.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.983 -1.462 . . . . 0.0 112.524 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.16 3.45 38.49 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 115.786 -0.643 . . . . 0.0 113.478 -176.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 6.6 mppt? -125.47 168.81 13.1 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.733 HG23 HD23 ' A' ' 144' ' ' LEU . 45.5 t -73.19 124.91 31.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.706 HG21 ' HG ' ' A' ' 33' ' ' LEU . 46.7 t -109.01 124.39 65.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.387 0.613 . . . . 0.0 111.462 -169.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.45 HD21 ' HZ ' ' A' ' 69' ' ' PHE . 12.2 tp -97.35 133.61 41.72 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 171.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.58 HG13 ' HB2' ' A' ' 118' ' ' PHE . 1.1 pt -118.1 106.9 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.185 0.517 . . . . 0.0 110.873 175.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.459 ' HB2' ' HA ' ' A' ' 73' ' ' GLN . 13.8 m-20 -98.22 133.28 42.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.858 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -117.33 97.32 5.84 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.439 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 11.1 t -143.7 179.27 7.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 -175.023 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.642 HG11 ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -126.02 124.29 65.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 120.725 0.298 . . . . 0.0 110.325 -178.879 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.689 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 28.8 m-85 -74.98 79.43 2.18 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.235 0.54 . . . . 0.0 110.006 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 41.3 t30 172.95 -32.33 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.366 -1.288 . . . . 0.0 108.661 174.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.642 ' HB2' HG11 ' A' ' 44' ' ' VAL . 37.4 t-20 -65.1 133.89 52.6 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.852 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -30.8 69.28 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.529 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 90.0 mtp -67.94 -22.54 65.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.347 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -71.14 -23.33 62.05 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.288 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.81 18.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.848 0.356 . . . . 0.0 110.718 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.04 -39.31 93.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.69 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.473 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.3 t60 -62.85 -45.12 94.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.991 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.649 ' HA ' HD11 ' A' ' 57' ' ' LEU . 5.3 m-20 -74.7 -22.17 58.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.782 -176.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.459 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -68.58 -43.57 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.36 -38.88 81.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.737 174.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.649 HD11 ' HA ' ' A' ' 54' ' ' ASN . 86.7 mt -62.51 -42.29 99.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.001 177.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.4 tpm_? -54.84 -36.03 64.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.777 176.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -79.97 -50.29 10.63 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -173.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.844 HD12 HD12 ' A' ' 140' ' ' ILE . 2.7 mm? -55.77 -30.72 61.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 113.271 -1.786 . . . . 0.0 111.429 178.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -72.72 -48.38 39.24 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.231 0.539 . . . . 0.0 109.685 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -63.38 -21.18 66.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.643 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.542 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 33.5 mttm -82.21 -61.32 1.93 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.925 -178.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.486 ' HB3' HD11 ' A' ' 144' ' ' LEU . 83.8 m-85 -113.35 -5.85 13.55 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -164.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.571 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.15 -34.9 75.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.248 0.476 . . . . 0.0 111.585 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 m -63.17 -22.07 66.62 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.775 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -98.57 18.59 16.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.701 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.04 54.43 1.62 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.344 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.571 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 54.0 t80 -132.29 125.9 32.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.71 0.29 . . . . 0.0 110.274 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.454 ' HB3' HD13 ' A' ' 33' ' ' LEU . 28.9 tt0 -125.36 154.73 41.4 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.573 ' HB ' ' CB ' ' A' ' 92' ' ' TRP . 49.8 mt -118.8 126.32 75.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.06 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.46 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 75.7 t80 -112.78 100.12 8.43 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.275 -0.875 . . . . 0.0 108.859 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.459 ' HA ' ' HB2' ' A' ' 41' ' ' ASP . 6.1 tt0 -102.48 126.32 49.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.348 -175.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 54.9 mt -103.56 129.09 56.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.339 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.689 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 3.8 p -95.85 131.63 41.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.449 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 22.2 mt -116.45 33.67 5.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.24 0.543 . . . . 0.0 109.741 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.489 ' OD2' ' HB2' ' A' ' 75' ' ' SER . 3.5 p30 -85.29 -165.91 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.752 -175.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -135.5 30.16 2.81 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.779 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -151.36 101.93 2.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.993 0.425 . . . . 0.0 110.632 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -64.98 -31.76 73.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.653 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -46.0 90.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.564 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -71.97 -42.02 67.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.834 0.349 . . . . 0.0 110.6 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 36.9 t90 -60.77 -48.38 82.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.747 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.463 ' HB2' ' HE3' ' A' ' 84' ' ' LYS . 37.2 ttmt -62.18 -42.14 98.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.806 -175.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 7.9 p -71.22 -40.15 71.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.831 0.348 . . . . 0.0 111.264 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.519 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 25.3 t -69.9 -45.62 67.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.713 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.454 ' HB1' HD12 ' A' ' 23' ' ' LEU . . . -66.95 -26.32 66.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.622 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.85 -31.34 71.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.763 0.315 . . . . 0.0 111.071 -178.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -102.64 7.86 39.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.935 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 86' ' ' SER . 40.0 mt -94.74 140.62 22.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.233 0.54 . . . . 0.0 111.339 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.582 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.2 Cg_endo -72.45 -49.3 0.28 Allowed 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 123.875 3.05 . . . . 0.0 113.938 -174.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.582 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.1 p90 -81.88 -172.31 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.984 0.421 . . . . 0.0 111.933 -173.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.441 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 90.6 t -85.8 117.52 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.357 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 34.1 m -113.68 108.8 17.61 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.911 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.591 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 23.2 m -114.77 172.1 4.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.934 -179.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -133.04 140.37 47.68 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.085 -177.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -93.03 151.0 20.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.06 -18.52 42.84 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -115.82 -12.17 11.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.812 0.339 . . . . 0.0 111.033 -175.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.449 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 66.41 -121.29 17.43 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.074 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.62 -6.81 43.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.765 0.316 . . . . 0.0 111.303 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -100.97 15.8 27.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.428 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.444 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.6 t -63.6 132.68 51.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.172 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.489 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 16.5 m -59.38 -28.95 67.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.172 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -60.79 -45.42 94.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.735 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.444 HG13 ' HB3' ' A' ' 103' ' ' SER . 43.2 mt -58.0 -36.2 55.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.113 0.482 . . . . 0.0 110.433 -177.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -72.67 -39.66 66.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.535 177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.7 mt -64.26 -32.12 73.58 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.573 -178.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -69.99 -27.3 64.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.947 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.451 ' C ' HD21 ' A' ' 110' ' ' ASN . 0.2 OUTLIER 57.97 61.91 2.22 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 -164.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.0 p -69.97 153.37 8.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 114.358 -1.292 . . . . 0.0 110.749 -176.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 47.5 p -93.82 -34.48 13.15 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.931 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.404 HD21 ' N ' ' A' ' 113' ' ' ASN . 0.0 OUTLIER -165.43 174.32 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.907 -178.065 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.564 HD22 ' HA ' ' A' ' 115' ' ' PRO . 0.3 OUTLIER -159.59 151.02 16.45 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -177.475 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.564 ' HA ' HD22 ' A' ' 114' ' ' LEU . 33.6 Cg_endo -63.83 139.97 36.87 Favored 'Cis proline' 0 C--N 1.354 0.858 0 C-N-CA 124.371 -1.096 . . . . 0.0 113.433 1.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.11 177.6 7.33 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.98 -177.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 7.9 p -138.05 159.25 33.09 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.627 ' HE2' ' HD2' ' A' ' 129' ' ' ARG . 86.2 m-85 -138.04 163.27 32.02 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 1.01 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.4 tp -110.98 135.03 52.1 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.745 -174.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.544 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 49.1 t -131.18 117.53 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.32 0.581 . . . . 0.0 110.301 172.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.496 ' HB2' HD22 ' A' ' 143' ' ' LEU . 31.4 t30 -70.84 161.15 31.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.439 ' HB3' HG21 ' A' ' 37' ' ' VAL . 17.0 ptt180 -73.88 29.68 0.08 Allowed 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -170.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.525 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 4.4 t-20 -120.37 2.97 10.83 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 169.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.638 ' O ' HG23 ' A' ' 15' ' ' ILE . 0.2 OUTLIER 69.28 62.78 0.29 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.709 -167.016 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.544 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 38.3 mt-10 -122.2 123.81 42.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.019 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 tt -62.04 106.8 0.76 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 171.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 1.01 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 47.0 m -83.08 -54.7 4.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.972 -172.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -167.66 172.13 9.58 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.755 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.627 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 19.6 mmt85 -78.62 175.39 10.43 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -80.63 -26.62 53.65 Favored Glycine 0 C--N 1.315 -0.585 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.616 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.435 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 mp0 -75.47 -41.85 54.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.164 0.507 . . . . 0.0 112.021 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.578 HD21 ' N ' ' A' ' 133' ' ' ILE . 0.2 OUTLIER -81.03 -6.58 58.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.704 -176.332 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.634 HG23 ' HG ' ' A' ' 136' ' ' LEU . 63.3 mt -85.61 110.26 19.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.313 0.578 . . . . 0.0 109.975 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -61.01 -25.36 66.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.026 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.463 ' OD2' ' HB3' ' A' ' 137' ' ' ASP . 36.2 t70 -173.05 116.48 0.28 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.634 ' HG ' HG23 ' A' ' 133' ' ' ILE . 3.4 mp -75.17 -28.52 60.11 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.924 -0.311 . . . . 0.0 111.043 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.463 ' HB3' ' OD2' ' A' ' 135' ' ' ASP . 9.3 t70 -53.51 -54.93 30.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 173.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.22 -48.55 68.07 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.666 172.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.465 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -64.24 -52.12 60.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.373 -172.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.844 HD12 HD12 ' A' ' 60' ' ' LEU . 37.6 mt -61.3 -36.83 75.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.275 0.56 . . . . 0.0 110.295 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 17.2 ttpt -60.11 -40.0 88.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.149 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 139' ' ' ALA . 17.1 ptpt -85.02 -19.73 31.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.244 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.513 HD13 ' HG ' ' A' ' 119' ' ' LEU . 16.0 mt -75.15 -32.83 61.43 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.682 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.733 HD23 HG23 ' A' ' 37' ' ' VAL . 34.0 mt -53.91 -35.47 61.68 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.518 178.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.673 ' HB2' ' HA ' ' A' ' 151' ' ' HIS . 9.2 pt-20 -84.11 -39.23 19.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.962 0.41 . . . . 0.0 110.149 176.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 114.81 -122.27 5.6 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.871 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -90.64 29.52 1.3 Allowed 'General case' 0 C--N 1.326 -0.413 0 O-C-N 122.791 -0.24 . . . . 0.0 110.838 -177.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . 0.662 ' HA ' ' OE1' ' A' ' 145' ' ' GLU . 0.5 OUTLIER 55.66 54.16 8.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.489 179.366 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 -141.34 8.6 2.02 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.318 174.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 33.4 t60 -174.7 95.84 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.046 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.673 ' HA ' ' HB2' ' A' ' 145' ' ' GLU . 32.3 p80 -70.09 162.7 27.74 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 175.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 45.5 t60 . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.453 -0.784 . . . . 0.0 109.024 171.48 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 120.689 0.28 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 m -80.4 146.88 31.25 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.227 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.557 HD11 ' N ' ' A' ' 4' ' ' GLU . 1.5 pp -80.0 -22.24 42.71 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.391 0.615 . . . . 0.0 110.623 177.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.557 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.7 OUTLIER -157.55 -175.05 5.17 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 106.082 -1.821 . . . . 0.0 106.082 175.369 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.508 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 45.6 mm 62.81 88.08 0.12 Allowed Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -171.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -58.18 164.28 8.76 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.296 2.664 . . . . 0.0 114.526 -166.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.657 ' HA ' ' HG3' ' A' ' 12' ' ' GLU . 7.5 pt-20 -151.09 104.62 3.15 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.732 -1.576 . . . . 0.0 108.439 -177.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -157.1 97.99 1.7 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.823 0.344 . . . . 0.0 111.804 -170.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm 68.63 -75.5 0.07 Allowed 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.145 175.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.8 pt -148.94 30.05 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 CA-C-N 114.557 -1.202 . . . . 0.0 110.563 -176.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -134.26 41.18 2.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.841 0.829 . . . . 0.0 110.34 -176.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.657 ' HG3' ' HA ' ' A' ' 7' ' ' GLU . 4.8 mp0 -74.88 134.99 41.54 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.182 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.511 ' C ' ' H ' ' A' ' 15' ' ' ILE . . . 68.23 -71.35 0.11 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.457 -173.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.1 t 70.23 -15.93 0.32 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.364 0.666 . . . . 0.0 111.662 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.511 ' H ' ' C ' ' A' ' 13' ' ' ALA . 5.3 tp -163.98 145.23 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.45 ' N ' HD13 ' A' ' 16' ' ' ILE . 4.1 mp -98.9 104.56 16.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.11 110.9 2.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.288 0.566 . . . . 0.0 110.093 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.446 HG23 ' CD1' ' A' ' 74' ' ' ILE . 25.1 mm -90.4 108.6 19.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.259 -178.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.616 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 19.4 mt-30 -105.31 99.8 9.4 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.192 0.52 . . . . 0.0 110.795 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.2 mt -138.35 159.0 43.19 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.606 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 46.0 mtmt -89.69 138.18 31.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.737 0.779 . . . . 0.0 111.395 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.628 ' OD1' ' HG ' ' A' ' 23' ' ' LEU . 9.9 t70 -71.09 169.04 15.85 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.819 -1.537 . . . . 0.0 109.821 176.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.829 HD12 ' HA ' ' A' ' 88' ' ' ASP . 2.5 pp -51.82 -34.68 41.34 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.695 0.759 . . . . 0.0 111.212 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -69.34 -6.91 32.76 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.115 177.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.523 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 89.74 7.91 68.18 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.308 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -101.69 118.29 36.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.553 0.216 . . . . 0.0 111.487 -175.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.606 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 24.3 m -58.28 124.01 18.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.223 0.535 . . . . 0.0 110.839 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.616 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.3 mmm180 -107.03 142.98 35.8 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.563 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.5 p -120.17 162.34 19.51 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.651 ' HB3' HD22 ' A' ' 124' ' ' ASN . 49.9 mt -80.1 -29.65 39.07 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.3 p -59.33 -22.89 61.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.701 173.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -85.5 -52.56 5.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.153 176.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -13.98 11.52 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.221 -178.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.664 ' HZ3' ' HB3' ' A' ' 34' ' ' LYS . 3.6 ttpm? -53.48 -14.98 0.91 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.224 1.01 . . . . 0.0 112.475 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.527 ' C ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.1 -16.37 59.8 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.651 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.527 ' HD2' ' C ' ' A' ' 35' ' ' GLY . 2.9 mptp? -136.14 -178.9 5.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 110.397 176.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.718 HG23 HD23 ' A' ' 144' ' ' LEU . 56.3 t -78.58 123.29 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 172.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.1 t -103.32 122.27 55.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.308 0.575 . . . . 0.0 112.204 -163.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.732 HD12 HD21 ' A' ' 136' ' ' LEU . 13.0 tp -92.06 122.13 34.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.739 171.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.511 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.0 mm -98.98 106.03 18.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.695 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 25.6 t70 -108.4 131.07 55.14 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.869 -178.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.495 ' HD2' HD13 ' A' ' 76' ' ' LEU . 32.7 m-85 -119.63 97.77 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.106 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.567 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.2 t -137.39 164.87 27.58 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.996 0.427 . . . . 0.0 111.233 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.53 HG21 ' HB2' ' A' ' 47' ' ' ASN . 3.4 m -102.49 116.75 46.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.051 0.453 . . . . 0.0 110.437 177.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.427 ' HB3' ' HA ' ' A' ' 83' ' ' TRP . 7.4 m-85 -74.89 84.13 2.2 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.699 0.761 . . . . 0.0 109.057 175.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 177.69 -37.81 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.149 -165.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.53 ' HB2' HG21 ' A' ' 44' ' ' VAL . 10.1 t-20 -89.76 146.56 24.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.383 -169.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.31 -30.77 71.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.724 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.3 mmm -64.27 -27.19 68.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.793 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.9 m -69.33 -28.25 66.07 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.164 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.72 -55.7 15.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.866 0.365 . . . . 0.0 110.67 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.03 77.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.623 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.484 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 67.8 t60 -66.13 -38.25 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.454 178.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.431 ' HA ' HD12 ' A' ' 57' ' ' LEU . 23.4 t-20 -66.95 -39.45 87.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.455 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -57.34 -50.23 73.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.501 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.03 83.8 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.005 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.4 mt -62.97 -42.38 99.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 109.943 175.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -61.68 -28.83 69.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.023 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -72.28 -53.25 13.02 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.713 HD11 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -56.56 -32.1 64.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 112.345 -2.207 . . . . 0.0 111.072 176.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -73.1 -47.66 42.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.119 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -61.93 -22.46 65.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.263 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -79.7 -55.83 4.72 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.666 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.563 ' HB3' HD12 ' A' ' 144' ' ' LEU . 93.6 m-85 -118.09 -11.4 10.18 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -165.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.505 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -56.33 -42.87 78.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -174.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.3 p -54.2 -43.48 70.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.414 -176.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -69.69 -33.21 72.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 151.81 47.74 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.303 -0.951 . . . . 0.0 112.582 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.633 ' HZ ' HD23 ' A' ' 39' ' ' LEU . 66.9 t80 -127.92 138.77 52.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.359 -0.238 . . . . 0.0 110.359 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.36 155.56 49.25 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.452 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 46.3 mt -116.84 114.97 47.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.446 0.641 . . . . 0.0 110.503 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.465 ' HH ' HG23 ' A' ' 95' ' ' VAL . 87.7 t80 -100.48 101.3 12.21 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.606 178.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.695 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 10.7 mt-30 -94.86 143.18 26.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.031 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.446 ' CD1' HG23 ' A' ' 18' ' ' ILE . 57.3 mt -127.21 124.88 65.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.715 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.609 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 10.7 p -92.49 129.91 38.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.947 0.403 . . . . 0.0 111.116 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.495 HD13 ' HD2' ' A' ' 42' ' ' PHE . 25.1 mt -112.45 10.5 19.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.88 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.609 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 3.9 p-10 -69.22 -49.99 51.32 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.322 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.94 -34.54 3.24 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.632 176.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -87.04 136.36 32.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.934 0.874 . . . . 0.0 111.367 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 44.1 tt0 -78.7 -29.0 45.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.7 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -79.59 -50.6 10.45 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.286 -167.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -65.44 -39.31 91.9 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.512 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 16.0 t90 -61.99 -47.93 82.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.792 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.685 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 46.2 tttm -68.34 -49.72 58.33 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.968 -176.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.6 p -58.93 -30.31 67.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.202 0.525 . . . . 0.0 111.423 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.1 m -82.84 -46.22 13.32 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.684 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.474 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.24 -18.8 27.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -171.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.829 ' HA ' HD12 ' A' ' 23' ' ' LEU . 3.6 t70 -55.36 -33.56 63.52 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.93 0.492 . . . . 0.0 111.981 -170.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -104.26 11.72 34.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.145 -176.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.506 ' HB3' ' HD2' ' A' ' 91' ' ' PRO . 23.3 mt -81.83 157.7 68.86 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 121.121 0.486 . . . . 0.0 111.712 -176.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.591 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 72.1 Cg_endo -69.8 -44.41 2.07 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.744 2.963 . . . . 0.0 114.208 -176.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.591 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -100.75 -170.69 1.89 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 112.005 -171.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.523 HG13 ' HG3' ' A' ' 28' ' ' ARG . 90.3 t -83.79 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.775 -176.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 84.0 m -136.17 108.81 7.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.07 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.465 HG23 ' HH ' ' A' ' 72' ' ' TYR . 14.6 m -113.89 159.8 13.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.009 -177.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 80' ' ' GLU . 12.2 ttp180 -117.73 134.42 54.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.379 -177.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -92.69 143.56 26.18 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.35 -14.09 55.84 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -99.95 -13.31 19.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.744 -172.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.406 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . 64.62 -98.45 0.28 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.747 178.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -105.92 1.49 26.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.956 0.408 . . . . 0.0 110.891 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -104.56 9.47 35.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.119 0.485 . . . . 0.0 110.193 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.527 ' HB2' HG13 ' A' ' 106' ' ' ILE . 4.2 m -65.27 122.21 16.59 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.554 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.53 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.3 m -55.17 -27.1 43.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.867 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -55.59 -47.24 76.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.613 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.527 HG13 ' HB2' ' A' ' 103' ' ' SER . 53.1 mt -57.07 -34.77 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.765 -176.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.9 m -77.17 -37.27 54.11 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 177.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 104' ' ' SER . 96.7 mt -63.58 -37.65 88.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.599 -178.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -71.53 -24.41 61.94 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.412 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 59.53 79.88 0.21 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 122.1 0.953 . . . . 0.0 108.758 -165.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.504 HG13 ' CG2' ' A' ' 106' ' ' ILE . 9.9 p -92.71 145.5 7.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.077 -174.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 15.1 m -90.81 -40.6 11.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.294 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -170.11 127.52 0.85 Allowed 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -174.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.46 HD13 ' OG ' ' A' ' 116' ' ' SER . 3.7 mm? -88.83 147.32 38.79 Favored Pre-proline 0 N--CA 1.465 0.28 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.97 143.02 74.8 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 123.86 -1.308 . . . . 0.0 112.919 0.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.46 ' OG ' HD13 ' A' ' 114' ' ' LEU . 13.3 m -121.04 169.99 9.96 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.464 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.8 p -142.25 156.71 19.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.511 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.7 m-85 -140.23 160.16 40.57 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.865 HD12 HD13 ' A' ' 136' ' ' LEU . 13.9 tp -111.0 134.93 52.21 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -174.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.6 t -135.51 120.44 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.775 0.321 . . . . 0.0 110.554 177.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.639 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.1 p30 -77.74 167.56 21.36 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 4.68 0.78 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -168.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -95.65 5.3 51.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.651 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.7 t-20 64.42 48.05 2.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.277 -172.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.639 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 42.4 mt-10 -119.12 136.85 53.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.615 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.86 118.05 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.324 0.583 . . . . 0.0 110.801 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.608 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 18.4 m -87.31 -53.45 4.83 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.877 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.09 169.14 14.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.172 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.472 ' O ' HG13 ' A' ' 133' ' ' ILE . 93.4 mtt180 -91.7 168.33 11.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.885 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -65.16 -36.55 93.03 Favored Glycine 0 CA--C 1.509 -0.316 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.442 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 pm0 -75.93 -0.14 20.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.086 0.469 . . . . 0.0 111.125 177.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -110.07 -19.47 13.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.167 0.508 . . . . 0.0 110.05 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.512 HD11 ' HB2' ' A' ' 119' ' ' LEU . 97.2 mt -82.9 108.3 15.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.73 -177.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.712 ' H ' ' HD2' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -82.99 -26.34 31.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.955 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -161.36 110.43 1.58 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.865 HD13 HD12 ' A' ' 119' ' ' LEU . 2.8 tp -76.78 -33.17 58.05 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.754 -175.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.442 ' HA ' HD13 ' A' ' 60' ' ' LEU . 10.1 t70 -51.54 -52.83 43.81 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.48 177.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.536 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 28.7 mm-40 -56.57 -52.22 65.64 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.64 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.456 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.97 -50.6 71.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.183 -172.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.72 HD11 ' HG ' ' A' ' 136' ' ' LEU . 52.2 mt -59.55 -40.54 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.213 0.53 . . . . 0.0 110.249 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.416 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 29.4 ttpt -56.78 -47.59 79.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.016 178.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.536 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 11.5 ptpt -81.54 -18.88 43.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.76 -176.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 40.2 mt -71.91 -39.59 69.42 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 110.401 173.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.718 HD23 HG23 ' A' ' 37' ' ' VAL . 66.6 mt -58.37 -39.74 80.39 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.504 0.669 . . . . 0.0 109.938 176.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.598 ' HA ' ' CE1' ' A' ' 152' ' ' HIS . 39.5 mt-10 -66.87 -64.32 0.88 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.055 175.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 98.77 -48.05 1.36 Allowed Glycine 0 N--CA 1.442 -0.93 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.772 -177.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . 0.56 ' O ' ' HD2' ' A' ' 150' ' ' HIS . 94.1 m-70 60.87 -89.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.435 0.694 . . . . 0.0 111.411 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 62.18 -78.45 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.95 0.5 . . . . 0.0 111.665 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -153.63 24.7 0.52 Allowed 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.56 ' HD2' ' O ' ' A' ' 147' ' ' HIS . 0.3 OUTLIER -142.2 169.14 18.14 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.729 178.631 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.512 ' O ' ' HB2' ' A' ' 152' ' ' HIS . 48.2 t60 -75.42 74.38 2.49 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.835 0.35 . . . . 0.0 110.725 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . 0.598 ' CE1' ' HA ' ' A' ' 145' ' ' GLU . 66.0 t-80 . . . . . 0 C--O 1.249 1.033 0 C-N-CA 124.202 1.001 . . . . 0.0 108.359 174.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 mmt . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.9 m -65.38 -45.48 83.87 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -97.38 93.34 6.43 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 168.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -78.34 137.24 37.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.816 -174.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 68.6 mt -107.52 112.68 62.31 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.403 -178.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -85.38 -179.76 3.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.681 2.254 . . . . 0.0 112.004 177.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.411 ' CD ' ' HG ' ' A' ' 14' ' ' SER . 14.2 pt-20 48.96 -171.75 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.478 1.111 . . . . 0.0 113.409 176.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -159.38 14.57 0.15 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.113 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.717 ' HG2' ' H ' ' A' ' 10' ' ' ILE . 3.2 ttmp? -137.84 -146.26 0.21 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.779 -167.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.717 ' H ' ' HG2' ' A' ' 9' ' ' LYS . 37.4 pt -77.96 170.83 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 167.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.872 ' HE2' HD13 ' A' ' 16' ' ' ILE . 6.0 tmtm? -51.43 109.6 0.36 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.171 0.51 . . . . 0.0 111.612 -177.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -130.28 -28.07 2.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.633 0.73 . . . . 0.0 110.081 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -126.27 -31.84 2.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.724 -1.126 . . . . 0.0 111.252 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.411 ' HG ' ' CD ' ' A' ' 7' ' ' GLU . 63.3 m -47.41 119.09 2.49 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.813 0.816 . . . . 0.0 111.699 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.4 tp -70.22 138.47 21.93 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 113.811 -1.541 . . . . 0.0 110.718 176.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.872 HD13 ' HE2' ' A' ' 11' ' ' LYS . 4.2 mp -101.69 126.23 55.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -80.03 108.02 13.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.482 HD11 ' OH ' ' A' ' 109' ' ' TYR . 11.1 mt -96.07 125.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.729 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.599 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 28.9 mt-30 -118.73 99.96 7.11 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.985 0.421 . . . . 0.0 110.365 -178.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.7 mt -133.63 156.46 47.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 95.4 mttt -87.64 139.63 30.34 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.053 0.454 . . . . 0.0 111.308 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.549 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 7.8 p30 -87.82 -167.22 1.81 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.892 -176.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.576 HD12 ' HB3' ' A' ' 87' ' ' ALA . 55.3 tp -50.02 -36.15 27.63 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.272 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.735 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 8.9 mtmp? -84.87 -5.53 59.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.497 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.88 17.48 63.27 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -176.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.47 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.9 OUTLIER -97.08 117.26 30.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.209 -0.496 . . . . 0.0 110.275 -177.717 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.582 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 54.7 m -61.74 118.94 7.8 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.153 0.501 . . . . 0.0 111.269 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.599 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.9 mmm180 -101.38 139.17 37.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.498 176.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 36.8 p -118.06 161.89 19.09 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 172.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.521 HD11 ' O ' ' A' ' 16' ' ' ILE . 58.0 mt -79.88 -21.29 44.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.642 0.734 . . . . 0.0 109.863 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.35 -8.21 52.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.625 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -89.94 -60.51 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.994 0.426 . . . . 0.0 110.512 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.4 ' CD2' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -77.96 9.18 3.81 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 121.782 0.801 . . . . 0.0 111.066 -177.265 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.601 ' HZ3' ' HB3' ' A' ' 124' ' ' ASN . 24.1 ttmm -54.75 141.45 32.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.477 171.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.64 -25.53 8.5 Favored Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 -173.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.736 ' HB2' ' HZ2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -120.96 170.62 9.33 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.287 173.346 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.633 HG11 ' HG2' ' A' ' 122' ' ' ARG . 1.6 m -79.95 134.71 26.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.466 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 41.3 t -117.02 130.98 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-O 121.184 0.516 . . . . 0.0 111.155 -170.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.515 ' HB3' HG23 ' A' ' 71' ' ' ILE . 11.8 tp -94.96 107.52 19.56 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.649 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.652 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.8 mm -85.6 105.49 14.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.43 ' CG ' ' HE2' ' A' ' 53' ' ' HIS . 1.8 t70 -107.18 131.6 53.97 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.287 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -116.03 97.32 6.01 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.719 ' O ' ' HA ' ' A' ' 75' ' ' SER . 22.7 m -144.63 147.32 32.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.182 0.515 . . . . 0.0 111.161 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.51 HG23 ' HB3' ' A' ' 77' ' ' ASP . 1.6 p -95.46 123.01 47.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 122.236 -0.29 . . . . 0.0 110.946 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.682 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 30.5 m-85 -82.69 79.07 9.2 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.01 0.91 . . . . 0.0 109.659 175.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.404 ' HB3' HG22 ' A' ' 44' ' ' VAL . 7.3 t-20 -178.13 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 113.569 -1.65 . . . . 0.0 109.078 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.505 ' HB2' ' CG1' ' A' ' 44' ' ' VAL . 30.0 t-20 -71.85 142.86 49.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.558 -178.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.07 -30.12 69.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.822 -175.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 21.8 ptp -71.45 -17.06 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.0 0.429 . . . . 0.0 111.088 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.2 m -71.17 -30.58 66.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.517 -177.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.61 -47.31 86.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.878 0.371 . . . . 0.0 111.137 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.133 0.492 . . . . 0.0 110.646 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.474 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.5 t60 -68.12 -40.89 82.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.625 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.521 ' HA ' HD12 ' A' ' 57' ' ' LEU . 92.5 m-20 -63.65 -34.01 76.91 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.792 0.33 . . . . 0.0 111.05 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.11 -53.75 54.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.415 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.54 -35.59 76.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.06 -178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 54' ' ' ASN . 86.8 mt -64.17 -41.55 97.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.515 0.674 . . . . 0.0 109.69 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 58' ' ' ARG . 28.5 tpt85 -64.56 -27.34 68.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.094 -178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.484 ' OE2' ' HE3' ' A' ' 63' ' ' LYS . 3.7 tm-20 -75.54 -56.16 4.97 Favored 'General case' 0 CA--C 1.489 -1.385 0 CA-C-O 123.003 1.382 . . . . 0.0 107.801 -174.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.529 HD11 HD13 ' A' ' 140' ' ' ILE . 3.0 mm? -55.02 -29.33 57.15 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 111.819 -2.446 . . . . 0.0 111.067 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.402 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 35.5 t80 -66.86 -49.17 66.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.24 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.34 -26.38 66.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.713 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.484 ' HE3' ' OE2' ' A' ' 59' ' ' GLU . 74.2 mttt -77.02 -61.48 1.97 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.685 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -109.54 -11.84 14.75 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -164.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.568 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.53 -37.9 82.69 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.189 0.45 . . . . 0.0 111.494 -177.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.4 m -65.11 -13.87 59.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.839 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -101.39 6.64 42.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.087 0.47 . . . . 0.0 110.955 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.51 54.24 0.89 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.175 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.612 ' HD1' HG22 ' A' ' 37' ' ' VAL . 37.2 t80 -130.57 131.66 45.13 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 178.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -130.69 156.15 45.4 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.589 HD12 ' CE3' ' A' ' 92' ' ' TRP . 43.6 mt -122.34 129.13 75.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-O 120.995 0.426 . . . . 0.0 110.152 -175.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.449 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 89.8 t80 -113.27 100.4 8.54 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.237 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.79 140.99 29.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.819 -177.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.466 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 59.9 mt -127.16 107.8 17.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.606 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.719 ' HA ' ' O ' ' A' ' 43' ' ' THR . 0.0 OUTLIER -77.77 129.44 35.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.998 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.41 ' H ' ' HA ' ' A' ' 44' ' ' VAL . 48.2 mt -110.34 38.75 2.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.51 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.1 p30 -100.72 -178.77 3.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.449 -175.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 -25.64 4.8 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.481 173.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.601 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 30.4 t70 -103.14 97.47 7.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.997 0.427 . . . . 0.0 110.689 -177.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.647 ' HB3' ' CZ ' ' A' ' 96' ' ' ARG . 10.0 pt-20 -74.79 -13.99 60.65 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.622 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . 0.601 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.2 OUTLIER -52.07 -50.59 61.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.403 173.367 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -70.81 -39.68 72.94 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.165 0.507 . . . . 0.0 110.553 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.601 ' HE3' ' HB2' ' A' ' 80' ' ' GLU . 31.4 t90 -60.27 -46.58 89.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.077 176.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -64.43 -43.73 93.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.281 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.7 p -69.45 -39.06 77.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.5 t -72.87 -37.41 67.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.599 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.618 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -70.17 -23.09 62.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.091 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.03 -27.08 68.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.708 0.766 . . . . 0.0 110.329 174.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -102.46 12.52 36.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.995 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.491 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 24.8 mt -97.98 147.35 32.95 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 121.408 0.623 . . . . 0.0 112.215 -177.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.743 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 14.8 Cg_endo -100.21 3.33 0.8 Allowed 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 124.495 3.463 . . . . 0.0 114.168 -176.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.743 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 2.4 p90 -136.72 -170.09 2.61 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.219 -0.301 . . . . 0.0 111.047 -174.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.48 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 78.7 t -80.89 127.02 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.945 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.618 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 1.6 p -129.63 103.38 6.82 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.209 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.549 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 6.4 m -114.73 156.24 15.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.647 ' CZ ' ' HB3' ' A' ' 80' ' ' GLU . 12.6 ttp180 -120.91 139.06 53.75 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.347 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -89.24 148.54 23.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.59 -16.4 51.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 0.0 111.697 -176.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -107.34 -12.15 15.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.17 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 62.31 -120.69 22.86 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.014 -177.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.48 -5.73 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.356 . . . . 0.0 111.476 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -99.6 12.87 35.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.525 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.424 ' HB3' HG13 ' A' ' 106' ' ' ILE . 42.9 t -64.9 133.53 52.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.798 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.2 m -63.31 -25.1 68.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.796 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -60.63 -44.15 96.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.353 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.424 HG13 ' HB3' ' A' ' 103' ' ' SER . 65.3 mt -56.73 -41.3 74.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.989 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.5 m -66.12 -27.81 68.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.965 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -73.9 -18.27 60.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.04 -179.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.624 ' HB2' HG23 ' A' ' 111' ' ' VAL . 87.8 m-85 -98.27 0.73 46.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.45 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 75.42 -5.28 2.2 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 123.972 0.795 . . . . 0.0 110.501 -177.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.624 HG23 ' HB2' ' A' ' 109' ' ' TYR . 92.3 t -58.34 129.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.415 -171.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.439 ' C ' HD21 ' A' ' 113' ' ' ASN . 20.1 p -130.79 16.02 5.28 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.973 176.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.439 HD21 ' C ' ' A' ' 112' ' ' THR . 1.0 OUTLIER -113.38 -100.89 0.42 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.277 -176.307 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.5 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 46.8 mt 67.93 154.68 0.14 Allowed Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 123.589 0.756 . . . . 0.0 112.436 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.5 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 17.3 Cg_exo -67.61 152.59 85.96 Favored 'Cis proline' 0 C--N 1.354 0.847 0 C-N-CA 123.442 -1.483 . . . . 0.0 111.934 0.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.463 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 68.7 m -151.21 175.84 11.78 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.034 0.445 . . . . 0.0 111.149 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.515 HG11 HD22 ' A' ' 136' ' ' LEU . 4.4 p -132.66 161.11 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.095 179.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.652 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.2 m-85 -137.42 162.02 34.76 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.907 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 11.9 tp -109.61 135.84 49.93 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.725 -176.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.536 ' CG1' ' HA ' ' A' ' 124' ' ' ASN . 4.0 t -129.84 125.63 61.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.227 0.537 . . . . 0.0 110.654 174.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.511 ' HA ' HG13 ' A' ' 37' ' ' VAL . 28.7 t30 -80.77 167.97 19.34 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.402 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.633 ' HG2' HG11 ' A' ' 37' ' ' VAL . 16.4 mtp180 -56.48 -25.15 50.23 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -165.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.702 ' HB2' ' CD ' ' A' ' 125' ' ' GLU . 90.4 m-20 -90.01 13.16 15.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -177.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.601 ' HB3' ' HZ3' ' A' ' 34' ' ' LYS . 2.8 t-20 60.48 57.55 2.77 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.407 -172.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.702 ' CD ' ' HB2' ' A' ' 123' ' ' ASN . 2.2 mp0 -109.33 134.91 51.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.178 175.028 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.497 HD11 ' HZ3' ' A' ' 11' ' ' LYS . 1.6 tt -67.42 107.08 2.31 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.907 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -78.78 -50.78 10.75 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.36 -173.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.09 167.31 10.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.5 -178.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.599 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -94.58 154.58 17.3 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.547 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -51.5 -41.33 48.8 Favored Glycine 0 C--N 1.33 0.231 0 O-C-N 123.434 0.458 . . . . 0.0 113.871 -175.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.445 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.6 OUTLIER -71.36 -18.09 62.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.897 0.38 . . . . 0.0 110.655 -178.016 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.508 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.8 OUTLIER -101.43 -15.14 17.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.719 -176.667 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.843 HG21 ' HG ' ' A' ' 136' ' ' LEU . 90.0 mt -77.08 99.84 2.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.163 0.506 . . . . 0.0 110.387 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.5 ptmt -74.31 87.77 2.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.202 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.41 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 33.8 t70 69.54 116.3 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.376 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.843 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.1 mp -76.13 -33.57 59.42 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.123 -177.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.501 ' HA ' HD13 ' A' ' 60' ' ' LEU . 10.3 t70 -54.15 -59.72 4.28 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.589 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 0.7 OUTLIER -51.89 -46.43 64.52 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.404 173.268 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.603 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.48 -51.71 68.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.033 0.382 . . . . 0.0 112.033 -174.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.623 HG13 ' O ' ' A' ' 136' ' ' LEU . 47.7 mt -57.64 -43.43 83.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.155 0.502 . . . . 0.0 110.081 177.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.476 ' HG2' ' OE1' ' A' ' 145' ' ' GLU . 26.4 ttpp -59.66 -50.83 72.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.951 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.603 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 24.9 pttt -73.35 -17.13 61.32 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 42.9 mt -70.62 -40.72 72.99 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 169.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 87.8 mt -67.93 -44.98 75.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.076 175.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.476 ' OE1' ' HG2' ' A' ' 141' ' ' LYS . 47.5 mt-10 -73.85 -2.99 26.05 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.723 177.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -71.51 -59.54 4.82 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 44.5 m80 60.33 -167.59 0.18 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.764 0.316 . . . . 0.0 110.479 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 28.3 p80 -119.54 24.7 10.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.712 0.767 . . . . 0.0 109.551 174.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -169.59 100.29 0.33 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.087 177.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -71.96 146.62 47.63 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 122.009 0.909 . . . . 0.0 113.1 -170.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -178.77 -44.81 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 178.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 6.1 t60 . . . . . 0 C--O 1.244 0.779 0 CA-C-N 112.973 -1.921 . . . . 0.0 106.91 165.54 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.3 mmt . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p -87.22 -26.2 23.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 169.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.499 HD13 ' O ' ' A' ' 127' ' ' SER . 48.3 tp -147.8 141.13 25.23 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.211 -1.359 . . . . 0.0 108.769 174.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -153.19 92.94 1.66 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.613 0.72 . . . . 0.0 110.637 176.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.444 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 48.2 mm -81.35 126.94 75.28 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.82 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 5' ' ' ILE . 8.4 Cg_exo -71.27 -168.72 0.36 Allowed 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.884 2.389 . . . . 0.0 112.61 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.428 ' CB ' ' HD3' ' A' ' 9' ' ' LYS . 38.9 mt-10 -130.38 156.28 44.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.341 -177.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -79.49 68.0 5.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.815 0.817 . . . . 0.0 109.518 174.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.428 ' HD3' ' CB ' ' A' ' 7' ' ' GLU . 53.1 mtpt -139.25 -143.82 0.17 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.82 -174.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.0 mm -69.37 -2.11 2.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.422 0.63 . . . . 0.0 111.912 -174.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.57 ' HZ1' ' HA ' ' A' ' 14' ' ' SER . 47.3 tttm -159.5 117.22 2.72 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.677 178.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -98.39 -172.99 2.44 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 168.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 40.36 87.22 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 172.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.57 ' HA ' ' HZ1' ' A' ' 11' ' ' LYS . 57.9 m -89.26 11.53 18.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.524 0.678 . . . . 0.0 109.939 175.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 tt -78.79 157.78 4.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.796 175.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.423 HD11 ' N ' ' A' ' 16' ' ' ILE . 4.3 mp -89.19 114.49 27.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.01 121.83 18.18 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.469 HD12 ' OH ' ' A' ' 109' ' ' TYR . 9.4 mt -105.07 106.83 21.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.675 -174.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.417 ' CG ' ' HB3' ' A' ' 29' ' ' SER . 19.2 mt-30 -102.05 100.43 10.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.024 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 97' ' ' ASP . 43.9 mt -138.38 156.7 47.35 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.3 mtmt -99.98 153.84 18.87 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 120.58 -0.448 . . . . 0.0 111.584 -172.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.76 -166.4 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.884 -174.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.52 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 6.3 mp -53.61 -46.77 70.54 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.729 177.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -68.32 -44.76 74.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.974 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.482 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 124.7 19.53 2.49 Favored Glycine 0 N--CA 1.44 -1.084 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.79 -176.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.467 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.9 OUTLIER -92.32 119.73 32.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.458 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.567 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 45.5 m -64.93 127.83 33.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.99 0.424 . . . . 0.0 111.31 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.468 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.2 mmm180 -108.84 136.32 48.59 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.417 ' HB3' ' CG ' ' A' ' 19' ' ' GLN . 57.3 p -119.0 165.46 14.08 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.578 ' HB3' HD22 ' A' ' 124' ' ' ASN . 64.7 mt -80.99 -28.59 35.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.084 0.469 . . . . 0.0 109.806 177.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 p -63.87 -20.84 66.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.086 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -81.38 -44.3 17.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 122.016 0.913 . . . . 0.0 108.572 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.487 HD21 HG11 ' A' ' 38' ' ' VAL . 2.7 tp -80.26 15.86 1.45 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.798 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.543 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 47.3 tttp -69.41 -14.29 62.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.905 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.14 10.73 65.01 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.324 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.603 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 3.4 mttm -144.97 177.9 8.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.08 0.467 . . . . 0.0 110.389 177.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.63 HG21 ' HD1' ' A' ' 69' ' ' PHE . 14.7 m -92.07 125.84 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.512 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 38.7 t -107.23 135.71 44.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 112.257 -165.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.582 HD11 HG22 ' A' ' 117' ' ' VAL . 2.0 tm? -96.38 120.22 36.3 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.478 -0.783 . . . . 0.0 108.961 170.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.582 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.1 mm -93.95 105.09 16.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 175.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.553 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 31.0 t0 -108.69 135.4 49.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 0.0 111.003 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.715 ' HB3' HD22 ' A' ' 114' ' ' LEU . 70.3 m-85 -123.4 115.44 21.62 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.288 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.421 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.1 t -155.95 174.13 15.78 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.736 0.303 . . . . 0.0 110.692 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.559 ' HB ' ' OD2' ' A' ' 77' ' ' ASP . 2.0 m -116.44 144.83 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.361 176.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.614 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 15.1 m-85 -102.24 81.03 2.03 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.6 . . . . 0.0 110.72 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.72 HD22 ' HB3' ' A' ' 79' ' ' ASP . 8.1 m-20 177.9 21.68 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.502 -1.681 . . . . 0.0 107.895 178.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -141.34 129.47 22.12 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.592 -163.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.85 78.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.039 -173.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -64.28 -21.24 66.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.011 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -74.64 -27.68 60.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.331 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.57 -51.46 35.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 110.894 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.36 -34.01 77.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.252 0.548 . . . . 0.0 110.44 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 68.3 t60 -67.45 -35.86 80.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.271 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -66.95 -37.3 84.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.608 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.6 tt -64.81 -42.04 95.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.361 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.48 85.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.301 0.572 . . . . 0.0 110.333 177.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -66.37 -41.33 89.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.69 176.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.428 ' HA ' ' HZ3' ' A' ' 92' ' ' TRP . 17.0 tpt180 -58.67 -31.94 68.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.102 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.83 -55.88 6.76 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.813 1.292 . . . . 0.0 107.728 -173.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.772 HD12 HD11 ' A' ' 140' ' ' ILE . 2.0 mm? -54.51 -31.74 56.67 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 112.124 -2.307 . . . . 0.0 111.388 177.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -76.72 -43.39 37.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.037 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -61.63 -22.05 64.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.323 0.582 . . . . 0.0 110.591 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -85.38 -61.62 1.72 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.546 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.548 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 95.7 m-85 -108.23 -8.79 15.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -165.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.476 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -65.97 -30.41 70.96 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 121.984 -0.447 . . . . 0.0 111.594 -176.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.8 m -68.24 -18.37 64.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.966 0.413 . . . . 0.0 111.038 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.548 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.4 mp0 -91.1 -61.97 1.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.425 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -177.4 38.88 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.876 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.63 ' HD1' HG21 ' A' ' 37' ' ' VAL . 73.5 t80 -113.17 145.67 40.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.603 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 9.3 tp10 -145.06 147.03 32.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 179.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.566 HD11 ' CE3' ' A' ' 92' ' ' TRP . 59.1 mt -111.79 131.18 63.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.982 0.42 . . . . 0.0 110.297 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.468 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.5 t80 -114.87 101.37 8.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.203 177.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.553 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 18.4 mt-30 -92.96 136.19 33.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.873 -177.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 56.4 mt -117.59 113.2 41.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.144 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 43' ' ' THR . 9.3 m -91.09 119.04 30.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.362 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.3 mt -100.97 15.23 29.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.409 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.614 ' HB2' ' H ' ' A' ' 45' ' ' TYR . 4.7 t70 -71.85 166.98 20.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.494 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.95 -18.5 46.92 Favored Glycine 0 N--CA 1.441 -1.017 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.584 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.72 ' HB3' HD22 ' A' ' 46' ' ' ASN . 9.6 t70 -111.19 114.71 28.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.305 0.574 . . . . 0.0 110.951 -178.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.561 ' HB3' ' NH1' ' A' ' 96' ' ' ARG . 11.0 pt-20 -80.15 -20.65 44.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.362 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -46.14 81.17 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.565 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -70.2 -34.65 73.19 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.52 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 12.5 t90 -59.86 -59.96 4.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.939 173.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -63.25 -40.42 97.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.275 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 59.8 m -68.31 -34.09 75.51 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.406 -178.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -23.36 29.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.062 0.458 . . . . 0.0 110.365 178.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.545 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -81.38 -18.22 46.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.405 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -53.69 -44.58 69.88 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 111.321 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.06 16.45 9.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.851 -178.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.545 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 17.7 mt -86.63 139.09 33.37 Favored Pre-proline 0 N--CA 1.452 -0.374 0 CA-C-O 121.439 0.638 . . . . 0.0 111.895 -179.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.687 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 73.6 Cg_endo -79.13 -30.78 2.51 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.818 3.012 . . . . 0.0 113.485 -176.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.687 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.2 p90 -105.28 -163.26 0.93 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.124 -173.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.64 127.39 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -177.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.8 t -129.67 115.91 18.05 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.6 m -121.95 177.96 3.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.5 -176.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.561 ' NH1' ' HB3' ' A' ' 80' ' ' GLU . 32.5 ttp180 -129.93 139.14 51.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.571 0.224 . . . . 0.0 110.593 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.496 ' HA ' HD21 ' A' ' 20' ' ' LEU . 18.4 t70 -83.32 151.07 25.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.942 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.22 -25.29 34.3 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -104.83 -12.78 16.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -173.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.73 -87.49 0.17 Allowed Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.972 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -107.22 -9.98 15.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.006 0.431 . . . . 0.0 110.973 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -103.01 22.62 13.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.114 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.439 ' HB2' HG13 ' A' ' 106' ' ' ILE . 2.2 m -69.25 133.63 48.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.067 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.536 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 14.5 m -57.1 -33.35 67.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.311 176.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -56.35 -48.07 77.54 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.393 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.656 HG21 ' CG1' ' A' ' 111' ' ' VAL . 41.9 mt -55.53 -37.42 45.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.666 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 32.8 t -77.92 -22.18 50.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.857 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.9 mt -80.3 -30.65 38.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.469 -177.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.469 ' OH ' HD12 ' A' ' 18' ' ' ILE . 82.7 m-85 -85.46 -19.92 30.52 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.033 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.424 ' C ' HD21 ' A' ' 110' ' ' ASN . 0.1 OUTLIER 54.95 56.58 6.46 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -162.522 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.656 ' CG1' HG21 ' A' ' 106' ' ' ILE . 8.9 p -58.84 -33.11 48.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.112 -1.404 . . . . 0.0 112.301 -169.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 25.1 m 71.26 -56.02 0.64 Allowed 'General case' 0 CA--C 1.534 0.345 0 O-C-N 123.378 0.424 . . . . 0.0 111.792 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -156.24 164.64 38.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.087 0.47 . . . . 0.0 111.056 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.715 HD22 ' HB3' ' A' ' 42' ' ' PHE . 0.6 OUTLIER -125.49 168.96 12.29 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.64 177.564 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -74.74 158.3 99.0 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 124.039 -1.234 . . . . 0.0 112.015 0.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 42' ' ' PHE . 13.6 m -125.86 155.03 41.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.037 0.446 . . . . 0.0 111.375 -173.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.582 HG22 HD11 ' A' ' 39' ' ' LEU . 5.5 p -144.08 143.48 23.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.31 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.582 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 75.9 m-85 -136.07 162.37 33.08 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.758 HD11 HD13 ' A' ' 136' ' ' LEU . 27.3 tp -111.06 143.66 41.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.512 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 53.5 t -133.84 126.6 51.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.532 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.685 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.5 p30 -83.29 167.97 17.12 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 49.2 ptt85 -63.97 1.57 0.65 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -168.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -98.5 7.06 46.64 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.578 HD22 ' HB3' ' A' ' 30' ' ' LEU . 2.7 t-20 60.99 57.33 2.58 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.845 -170.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.685 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 39.8 mt-10 -129.27 145.27 51.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.355 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.04 110.93 4.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.277 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.499 ' O ' HD13 ' A' ' 3' ' ' LEU . 7.7 m -80.51 -47.6 14.01 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.693 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.21 165.81 10.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.212 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.608 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 12.1 mpt_? -92.2 162.09 14.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 175.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.06 -44.82 92.91 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 121.485 -0.388 . . . . 0.0 112.845 -176.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.608 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.2 OUTLIER -68.88 -23.07 64.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.155 0.502 . . . . 0.0 110.481 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -92.68 -1.87 56.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.95 -176.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.601 HG23 HD12 ' A' ' 136' ' ' LEU . 96.5 mt -99.54 99.85 9.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.558 0.694 . . . . 0.0 110.302 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.417 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 13.1 ptmm? -60.51 -36.38 78.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.065 176.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.417 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 23.5 t70 -166.0 116.75 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.353 -176.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.758 HD13 HD11 ' A' ' 119' ' ' LEU . 1.8 tp -75.96 -26.66 57.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.57 -175.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -54.89 -53.43 55.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.719 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -58.53 -51.1 71.31 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.029 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.627 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.66 -54.54 42.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.905 -173.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.772 HD11 HD12 ' A' ' 60' ' ' LEU . 38.5 mt -63.33 -35.23 71.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.796 0.331 . . . . 0.0 111.008 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -62.39 -49.8 74.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.006 0.431 . . . . 0.0 110.462 178.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.93 -23.73 63.26 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.5 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 78.4 mt -66.85 -40.26 87.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.104 0.478 . . . . 0.0 110.103 173.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 96.7 mt -70.27 -40.47 74.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.823 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -62.07 -34.44 76.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.042 175.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 47.3 35.59 9.79 Favored Glycine 0 CA--C 1.521 0.407 0 N-CA-C 115.443 0.937 . . . . 0.0 115.443 165.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 37.2 m80 71.52 -8.04 1.12 Allowed 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 173.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -69.34 118.63 12.46 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 118.9 0.773 . . . . 0.0 110.03 -176.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 68.58 7.17 5.88 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.057 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 46.2 m80 67.62 2.33 2.94 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.467 0.707 . . . . 0.0 112.74 176.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -170.23 178.23 3.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.42 . . . . 0.0 111.045 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.164 -0.922 . . . . 0.0 109.036 174.234 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.8 ttm . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.904 0.383 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.3 m -110.74 -174.85 2.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.846 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -77.01 76.72 3.56 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -117.45 98.66 6.52 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.356 -176.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 49.2 mm -105.72 118.59 54.98 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.483 -177.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.76 22.91 0.8 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.037 2.491 . . . . 0.0 113.562 -176.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -99.89 78.37 2.11 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.986 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.408 ' C ' ' HD2' ' A' ' 9' ' ' LYS . 8.6 t70 -82.17 168.77 17.36 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.492 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 12.0 mptt -111.77 -8.27 14.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.618 0.723 . . . . 0.0 110.645 -176.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.1 mt -118.59 14.75 7.07 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 114.656 -1.156 . . . . 0.0 107.936 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.453 ' HB3' ' HE2' ' A' ' 11' ' ' LYS . 31.0 ttpt -174.65 56.69 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.284 -1.326 . . . . 0.0 108.872 -173.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -55.38 136.89 49.0 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.341 -179.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 58.14 68.56 0.82 Allowed 'General case' 0 C--O 1.234 0.257 0 O-C-N 123.836 0.71 . . . . 0.0 110.387 -174.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.8 m -70.06 -33.39 71.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.358 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.6 tp -162.23 139.25 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.434 177.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.47 HD11 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -100.81 103.68 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.49 108.52 2.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.335 0.588 . . . . 0.0 110.521 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 29' ' ' SER . 19.4 mm -87.15 124.2 40.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.645 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.564 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 11.0 mt-30 -120.86 100.43 7.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.89 0.376 . . . . 0.0 111.149 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.3 mt -142.03 153.88 44.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.225 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.55 ' HA ' ' O ' ' A' ' 26' ' ' ASN . 92.6 mttt -79.81 144.54 33.44 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.244 0.545 . . . . 0.0 110.528 178.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.553 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 3.3 p-10 -90.55 -169.84 2.53 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.04 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.498 ' CD2' ' HA ' ' A' ' 88' ' ' ASP . 37.9 tp -59.0 -36.4 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.42 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.423 ' HB2' HD21 ' A' ' 26' ' ' ASN . 91.6 mttt -69.71 -24.59 63.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.166 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.63 15.22 21.41 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.218 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.55 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 53.7 m-80 -99.51 122.52 42.71 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 17.0 m -66.72 106.87 1.96 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 172.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.564 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -86.82 142.43 28.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.082 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.538 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 73.8 p -121.72 156.95 32.01 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 172.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.589 ' HB3' HD22 ' A' ' 124' ' ' ASN . 53.7 mt -74.38 -27.02 60.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.091 0.472 . . . . 0.0 109.868 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.8 p -67.81 -14.79 63.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.187 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -91.28 -40.25 11.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 0.0 109.446 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.544 HD21 HG13 ' A' ' 38' ' ' VAL . 3.4 tp -77.11 3.65 12.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.346 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.46 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 36.9 ttpt -61.22 -18.42 58.23 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.436 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -71.73 -12.39 74.22 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.588 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -123.7 -177.89 3.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.98 0.419 . . . . 0.0 110.103 177.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.671 HG21 ' HD1' ' A' ' 69' ' ' PHE . 5.5 m -93.71 126.75 46.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 167.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 22.1 t -102.16 129.45 53.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.255 0.55 . . . . 0.0 112.132 -165.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.715 HD11 ' HZ ' ' A' ' 69' ' ' PHE . 6.2 tt -92.87 110.06 21.51 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 171.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.604 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 35.0 mm -84.74 106.15 14.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.99 0.424 . . . . 0.0 110.31 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.637 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 5.4 t70 -104.14 134.61 47.11 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.123 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -119.54 108.91 15.09 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.482 ' O ' ' HA ' ' A' ' 75' ' ' SER . 6.4 t -143.85 -175.45 4.59 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.219 0.533 . . . . 0.0 110.75 -174.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.731 HG11 ' HB2' ' A' ' 47' ' ' ASN . 2.5 p -145.12 128.15 10.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.653 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.522 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 30.1 m-85 -78.12 79.4 4.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.853 0.835 . . . . 0.0 109.807 178.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 176.1 -27.56 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 113.543 -1.662 . . . . 0.0 109.687 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.731 ' HB2' HG11 ' A' ' 44' ' ' VAL . 41.7 t-20 -73.21 135.33 44.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.729 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.82 68.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.345 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.21 -24.43 63.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.8 m -63.29 -28.98 70.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -176.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.38 -59.62 4.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.833 0.349 . . . . 0.0 111.256 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.05 -32.72 73.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.922 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.416 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 67.8 t60 -62.46 -42.96 99.84 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.022 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -70.04 -21.59 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.662 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.3 -44.02 65.96 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 177.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.3 75.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.36 0.6 . . . . 0.0 110.091 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.454 ' HB3' HD12 ' A' ' 71' ' ' ILE . 82.9 mt -65.96 -40.61 91.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.837 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 28.5 tpt180 -60.68 -28.82 68.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.22 177.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.55 -56.97 4.14 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 122.528 1.156 . . . . 0.0 108.148 -171.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.68 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -57.91 -32.48 67.79 Favored 'General case' 0 N--CA 1.425 -1.68 0 CA-C-N 112.348 -2.205 . . . . 0.0 111.515 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -75.65 -44.43 42.6 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.293 0.568 . . . . 0.0 109.647 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.514 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 15.1 t30 -59.75 -26.11 65.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.866 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -83.55 -61.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.701 -1.136 . . . . 0.0 112.434 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -105.69 -7.2 18.58 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -163.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.557 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.17 -35.37 69.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.12 0.418 . . . . 0.0 111.93 -177.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 m -66.21 -12.44 56.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.183 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -106.27 17.58 23.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.173 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.02 46.39 3.11 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.113 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.715 ' HZ ' HD11 ' A' ' 39' ' ' LEU . 46.9 t80 -120.8 136.24 54.95 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -142.59 142.79 32.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.193 0.52 . . . . 0.0 110.277 -176.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.474 HG23 HD22 ' A' ' 39' ' ' LEU . 60.0 mt -102.52 132.66 48.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.3 -176.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.478 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.7 t80 -115.7 101.2 8.62 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.676 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.637 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 2.0 mt-30 -90.72 128.08 36.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.469 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.3 mt -109.01 109.36 28.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.706 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 43' ' ' THR . 1.1 m -93.94 142.1 27.76 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.454 -178.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.404 HD13 HD22 ' A' ' 114' ' ' LEU . 45.1 mt -115.73 27.79 9.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.835 0.35 . . . . 0.0 110.96 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -84.1 178.48 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.871 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -137.73 35.43 2.05 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.983 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -138.36 134.14 33.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.984 0.421 . . . . 0.0 110.363 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -77.45 -31.42 53.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 51.0 m80 -68.79 -51.88 36.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.439 -167.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -71.49 -44.55 64.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.522 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 56.7 t90 -59.68 -49.6 77.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.491 -179.221 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 51.9 tttm -61.33 -61.72 2.34 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -177.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.8 m -55.44 -38.77 69.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.037 -173.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.479 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.4 m -74.48 -39.51 62.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.421 -177.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.44 -20.87 26.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.062 0.458 . . . . 0.0 111.458 -174.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.532 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -60.0 -35.54 75.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.532 -176.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -96.26 8.52 43.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.732 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 86' ' ' SER . 25.6 mt -93.82 149.05 36.4 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-O 121.249 0.547 . . . . 0.0 111.55 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.548 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 98.6 Cg_endo -74.32 -56.96 0.07 OUTLIER 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.59 2.86 . . . . 0.0 113.86 -175.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.548 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.5 p90 -83.37 -166.5 1.39 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.946 -169.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -87.52 133.32 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.813 -171.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 83.3 m -133.14 110.66 10.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.904 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.553 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 16.0 m -116.34 163.34 13.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.928 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -129.98 144.04 51.12 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.445 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -76.48 162.03 28.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.103 178.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.54 -34.95 65.45 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -177.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.421 HD21 ' HA ' ' A' ' 99' ' ' ASN . 1.0 OUTLIER -122.43 -11.27 8.34 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.751 -174.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.76 -113.72 3.82 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.252 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.31 5.58 4.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.851 0.358 . . . . 0.0 111.892 -174.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -110.29 9.51 23.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.973 0.416 . . . . 0.0 110.206 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 14.4 t -63.83 130.2 43.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.127 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.7 m -58.49 -28.95 65.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.699 -177.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.475 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 80.3 m-85 -61.54 -36.9 81.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.007 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.453 HG21 ' HB ' ' A' ' 111' ' ' VAL . 62.3 mt -59.08 -34.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.603 -175.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 41.2 m -80.09 -18.6 49.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.921 0.391 . . . . 0.0 111.115 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.4 mt -81.0 -33.44 33.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.07 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.55 ' HB2' HG22 ' A' ' 111' ' ' VAL . 78.3 m-85 -83.76 -9.43 58.81 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.81 178.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.9 t30 62.6 78.38 0.29 Allowed 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 -168.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.817 HG12 HD13 ' A' ' 114' ' ' LEU . 21.3 t -119.51 89.9 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 CA-C-O 121.339 0.59 . . . . 0.0 110.306 -178.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 13.4 p -91.59 -4.74 54.98 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.288 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -148.17 84.72 1.52 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.2 0.524 . . . . 0.0 111.427 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.817 HD13 HG12 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -83.08 157.84 65.34 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 170.48 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.554 ' HA ' ' CD2' ' A' ' 114' ' ' LEU . 7.5 Cg_exo -71.24 162.83 87.21 Favored 'Cis proline' 0 C--N 1.352 0.722 0 C-N-CA 124.64 -0.983 . . . . 0.0 113.409 1.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 49.2 m -143.82 173.85 11.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.386 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.83 156.41 17.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.449 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.604 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 78.3 m-85 -146.36 158.68 43.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.757 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 17.7 tp -112.57 145.31 40.56 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.924 -177.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.6 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 34.6 t -138.5 126.12 28.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.645 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -80.92 168.26 18.93 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -76.72 16.3 0.53 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -172.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -105.8 10.59 32.58 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 167.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.589 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.9 t-20 56.48 63.75 1.88 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.908 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.6 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 46.1 mt-10 -127.46 140.87 51.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.673 176.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.5 tt -69.68 107.75 3.58 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.757 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 52.6 m -74.53 -52.98 10.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.335 -177.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -165.56 164.5 19.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.116 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.573 ' O ' HG13 ' A' ' 133' ' ' ILE . 99.4 mtt180 -102.06 151.62 21.93 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.448 ' C ' ' H ' ' A' ' 132' ' ' ASN . . . -54.83 155.62 8.39 Favored Glycine 0 N--CA 1.452 -0.237 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 173.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' A' ' 130' ' ' GLY . 26.2 mm-40 71.84 -40.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.119 0.568 . . . . 0.0 110.742 -172.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.472 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.8 OUTLIER -80.39 -29.86 37.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.954 0.407 . . . . 0.0 110.026 177.131 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.573 HG13 ' O ' ' A' ' 129' ' ' ARG . 51.3 mt -59.52 -44.32 92.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.807 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 132' ' ' ASN . 50.9 mttp 74.29 -58.47 0.58 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.428 0.691 . . . . 0.0 110.851 179.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -139.77 110.47 6.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.541 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.879 HD13 HD11 ' A' ' 140' ' ' ILE . 0.3 OUTLIER -77.11 -28.01 54.25 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.11 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.406 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.0 t70 -57.21 -52.27 65.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.693 0.282 . . . . 0.0 111.012 -172.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.46 -34.97 79.13 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.015 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.582 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -63.26 -52.36 62.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.694 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.879 HD11 HD13 ' A' ' 136' ' ' LEU . 30.1 mt -65.15 -40.04 87.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -62.75 -44.22 96.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.845 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -72.02 -19.7 61.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 79.1 mt -68.48 -39.76 81.22 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.637 0.732 . . . . 0.0 109.349 171.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.4 mt -74.37 -44.58 51.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.918 177.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -71.47 -2.54 17.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.119 176.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -68.8 -15.06 68.53 Favored Glycine 0 C--N 1.333 0.394 0 N-CA-C 111.756 -0.537 . . . . 0.0 111.756 173.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 35.1 p-80 -135.51 86.91 2.28 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -148.85 -177.59 5.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.224 -166.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 65.4 m-70 -135.84 132.09 36.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 168.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.559 ' O ' ' HB2' ' A' ' 151' ' ' HIS . 3.2 t60 72.06 140.88 0.05 Allowed 'General case' 0 C--O 1.234 0.287 0 O-C-N 124.36 1.038 . . . . 0.0 108.68 -170.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.559 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 45.8 m170 75.94 -58.03 0.55 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -164.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 69.2 t60 . . . . . 0 C--O 1.246 0.915 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.953 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 120.638 0.256 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.3 m -143.05 -79.5 0.22 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.972 0.415 . . . . 0.0 110.242 -177.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.31 48.62 0.18 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -82.43 10.48 7.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.643 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.8 tt -99.64 100.82 11.7 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.58 174.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -82.69 9.45 4.04 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.657 2.238 . . . . 0.0 113.391 -174.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -86.53 173.83 9.34 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.175 -174.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 52.88 21.13 1.87 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.363 1.065 . . . . 0.0 112.03 -178.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -107.75 -170.61 1.72 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.109 176.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.1 pt -90.43 1.72 7.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.917 0.865 . . . . 0.0 109.897 174.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.511 ' HG3' ' OG ' ' A' ' 14' ' ' SER . 19.9 tptm -131.5 83.0 2.07 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.344 -1.298 . . . . 0.0 108.567 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.47 152.33 24.04 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.478 -175.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.93 31.35 19.97 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 123.803 0.689 . . . . 0.0 112.345 174.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.511 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 8.1 m -55.08 -44.45 74.84 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.531 0.682 . . . . 0.0 109.462 174.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.7 tp -159.66 123.02 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.581 174.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.453 ' O ' HD12 ' A' ' 30' ' ' LEU . 95.0 mt -87.6 101.94 11.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.885 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -68.73 107.87 3.18 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.803 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 29' ' ' SER . 23.4 mm -87.93 113.8 25.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.222 -178.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.495 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 80.3 mt-30 -108.78 100.26 9.51 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.377 0.608 . . . . 0.0 110.864 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.622 ' HB2' HG11 ' A' ' 95' ' ' VAL . 45.5 mt -137.99 159.98 40.58 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 41.6 mttp -89.01 135.4 33.57 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.154 0.502 . . . . 0.0 111.532 -177.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.547 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 21.5 p30 -81.79 -167.26 1.45 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.587 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.534 HD23 ' HB3' ' A' ' 87' ' ' ALA . 91.1 mt -50.33 -35.98 30.08 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.601 ' HB2' ' HZ1' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -83.86 -6.54 59.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.718 -176.502 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.85 12.76 70.96 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -173.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.545 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.8 OUTLIER -88.06 112.96 23.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.262 -0.469 . . . . 0.0 110.181 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.581 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.0 m -61.88 111.38 1.87 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.154 0.502 . . . . 0.0 111.144 177.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 14.4 mmt180 -90.64 142.52 27.67 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.55 173.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.495 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 79.6 p -119.22 165.6 14.03 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 171.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.684 ' HB3' HD22 ' A' ' 124' ' ' ASN . 62.8 mt -79.61 -24.93 41.63 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 p -68.09 -18.26 64.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.938 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -83.3 -41.36 18.37 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.66 0.743 . . . . 0.0 109.449 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.713 HD21 HG13 ' A' ' 38' ' ' VAL . 4.6 tp -76.1 -7.19 54.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.727 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.61 ' HB3' ' NZ ' ' A' ' 34' ' ' LYS . 1.1 ttpm? -61.17 99.83 0.11 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.128 175.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.88 -30.76 0.21 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -174.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.601 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 86.4 mttt -113.2 177.5 4.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 167.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.808 HG23 ' HD1' ' A' ' 69' ' ' PHE . 13.0 m -82.35 130.72 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.713 HG13 HD21 ' A' ' 33' ' ' LEU . 43.6 t -101.72 124.03 55.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.178 0.514 . . . . 0.0 111.751 -167.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.538 HD23 ' HZ ' ' A' ' 69' ' ' PHE . 12.4 tp -94.28 112.6 24.4 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.765 175.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.599 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.4 mm -85.2 105.27 13.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.488 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 29.2 t70 -107.8 110.83 22.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.744 -178.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.401 ' HB3' HD12 ' A' ' 114' ' ' LEU . 36.1 m-85 -95.05 105.18 17.08 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.531 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.6 t -137.56 -175.84 4.2 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.402 0.62 . . . . 0.0 111.563 -170.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.548 HG21 ' HB3' ' A' ' 77' ' ' ASP . 0.2 OUTLIER -143.0 122.39 8.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.782 178.654 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.685 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 49.4 m-85 -81.27 79.97 7.8 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 9.7 t30 174.79 -30.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.846 175.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.443 ' CB ' HG13 ' A' ' 44' ' ' VAL . 38.4 t-20 -66.82 134.53 52.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.507 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.27 -30.87 70.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.305 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.8 tpt -64.29 -30.1 71.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.906 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 m -68.46 -28.27 66.9 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.356 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.91 -53.75 45.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.864 0.364 . . . . 0.0 110.929 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.78 63.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.198 0.523 . . . . 0.0 110.604 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.485 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.1 t60 -65.3 -44.23 88.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.041 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.454 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.6 m-20 -66.3 -27.15 67.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.647 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.44 -55.11 34.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.262 0.553 . . . . 0.0 109.839 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.57 -32.92 73.03 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.845 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.1 mt -64.45 -39.48 93.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.864 176.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -62.35 -33.34 74.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.492 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.55 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 2.2 tt0 -71.77 -52.61 16.79 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.823 HD13 HD11 ' A' ' 140' ' ' ILE . 1.5 mm? -51.69 -34.97 40.82 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 112.952 -1.931 . . . . 0.0 111.577 177.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -75.9 -41.52 51.71 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.189 0.518 . . . . 0.0 110.065 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.415 HD21 ' HA ' ' A' ' 62' ' ' ASN . 8.9 m120 -65.28 -21.43 66.72 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.832 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.592 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 36.3 mttm -80.99 -61.73 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.602 -178.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.435 ' HE1' ' HG3' ' A' ' 141' ' ' LYS . 71.1 m-85 -111.21 -10.91 14.27 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -163.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.573 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.88 -31.31 71.58 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.307 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.5 m -64.18 -24.88 67.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.978 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -96.12 -6.93 37.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.027 0.442 . . . . 0.0 110.67 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.418 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 117.27 64.41 0.33 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.638 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.808 ' HD1' HG23 ' A' ' 37' ' ' VAL . 34.4 t80 -134.44 141.93 46.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.625 ' HG2' HD12 ' A' ' 33' ' ' LEU . 7.9 tp10 -140.24 148.6 41.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.351 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.562 ' HB ' ' CG ' ' A' ' 92' ' ' TRP . 48.0 mt -112.51 124.93 69.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.018 0.437 . . . . 0.0 109.963 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.569 ' CE1' HG21 ' A' ' 95' ' ' VAL . 88.2 t80 -109.86 100.43 9.41 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.488 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.4 mt-30 -92.2 135.43 34.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.092 0.472 . . . . 0.0 111.29 -178.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 68.2 mt -117.95 110.77 31.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.458 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.714 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 34.6 p -85.35 136.95 33.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.689 0.28 . . . . 0.0 111.114 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 101' ' ' ALA . 50.8 mt -105.39 13.74 29.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.812 0.339 . . . . 0.0 110.829 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.714 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 2.2 p-10 -86.47 163.04 17.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.969 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -98.09 -29.06 7.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.768 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.475 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 13.5 t0 -76.45 110.19 10.79 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.397 0.618 . . . . 0.0 110.669 -178.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.589 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 32.1 tt0 -70.93 -19.94 62.52 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.334 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . 0.475 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.0 OUTLIER -71.53 -45.04 63.48 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.835 -175.756 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -71.14 -44.95 64.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.977 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.497 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 39.2 t90 -55.9 -42.84 76.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.354 172.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.589 ' HB2' ' O ' ' A' ' 80' ' ' GLU . 11.5 tppt? -60.91 -57.47 12.52 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.96 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 p -65.14 -41.42 94.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.296 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.2 m -67.69 -37.46 82.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.424 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.534 ' HB3' HD23 ' A' ' 23' ' ' LEU . . . -86.58 -17.74 33.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.604 -177.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -50.18 -35.04 24.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.039 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -109.76 16.04 22.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.536 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 87' ' ' ALA . 27.8 mt -89.63 146.88 36.53 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.144 0.497 . . . . 0.0 111.525 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.67 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 93.1 Cg_endo -79.96 -40.49 0.23 Allowed 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 123.694 2.929 . . . . 0.0 114.027 -176.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.67 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.0 p90 -96.15 -168.09 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.783 0.325 . . . . 0.0 111.627 -170.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.401 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 24.8 t -81.61 120.29 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 121.148 0.499 . . . . 0.0 110.528 -171.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 35.0 m -116.3 106.54 13.77 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.956 -176.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.622 HG11 ' HB2' ' A' ' 20' ' ' LEU . 7.9 t -121.29 159.69 23.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.463 -172.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.566 HH12 ' HB2' ' A' ' 80' ' ' GLU . 54.0 ttp180 -120.34 141.78 49.73 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.763 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.532 ' HA ' HD12 ' A' ' 20' ' ' LEU . 30.4 t70 -73.2 160.53 31.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.321 177.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.79 -28.43 33.21 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -174.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.459 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 33.4 t30 -122.49 -12.69 8.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 112.46 -172.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.55 84.72 0.23 Allowed Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.651 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.417 ' HA ' HD13 ' A' ' 76' ' ' LEU . . . 75.19 -32.78 0.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.46 0.704 . . . . 0.0 111.926 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.459 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 52.3 m-85 -86.28 37.04 0.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.066 0.46 . . . . 0.0 110.016 176.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.44 ' HB3' HG13 ' A' ' 106' ' ' ILE . 23.1 t -87.22 136.73 32.82 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.346 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.8 m -61.83 -29.25 70.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.06 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -64.79 -41.42 95.84 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.843 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.44 HG13 ' HB3' ' A' ' 103' ' ' SER . 71.7 mt -56.81 -38.78 60.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.165 -178.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 36.1 t -68.91 -28.62 66.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.758 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.43 -26.68 61.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.94 0.4 . . . . 0.0 110.56 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -83.85 -1.55 54.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 68.92 5.21 4.89 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.805 0.812 . . . . 0.0 110.198 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.614 HG11 ' HG ' ' A' ' 114' ' ' LEU . 8.7 t -58.49 119.86 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.882 -174.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 3.4 m -110.12 -4.59 15.72 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.616 174.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -149.41 114.24 5.37 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.343 -176.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.614 ' HG ' HG11 ' A' ' 111' ' ' VAL . 53.8 mt -118.86 165.6 16.42 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 170.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.564 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.18 158.89 91.82 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.614 0.898 . . . . 0.0 113.582 1.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.1 m -155.22 164.3 38.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.012 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.43 154.05 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.599 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.1 m-85 -132.35 161.86 32.52 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.671 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.4 tp -110.85 131.67 54.85 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.946 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 23.0 t -129.31 127.4 65.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 174.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.449 ' HB3' HD22 ' A' ' 143' ' ' LEU . 8.0 p30 -83.78 170.76 13.82 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.029 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -60.81 -12.67 11.54 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 124.272 0.983 . . . . 0.0 113.544 -164.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -95.71 13.46 26.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.684 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.6 t-20 61.01 54.78 3.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.841 -174.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.471 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.9 mm-40 -122.25 137.36 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.54 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 126' ' ' LEU . 10.0 mt -68.49 112.27 5.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 0.0 110.437 175.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.671 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 24.4 m -81.37 -55.02 4.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.005 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -168.33 172.39 8.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.46 -175.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.677 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -93.94 161.88 14.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 108.96 176.001 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.499 ' HA2' HD11 ' A' ' 133' ' ' ILE . . . -48.05 -48.99 24.91 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 114.7 0.64 . . . . 0.0 114.7 -172.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.85 -26.87 59.99 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 117.028 0.414 . . . . 0.0 110.739 -176.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.424 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -72.35 -34.18 67.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.877 175.416 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.929 HG22 ' HG ' ' A' ' 136' ' ' LEU . 49.1 mt -69.46 -40.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.56 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.578 ' HG3' ' C ' ' A' ' 133' ' ' ILE . 0.0 OUTLIER 48.45 -86.51 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.287 0.992 . . . . 0.0 112.023 -173.273 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -88.43 84.78 6.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.093 -176.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.929 ' HG ' HG22 ' A' ' 133' ' ' ILE . 4.6 mp -60.6 -32.53 71.65 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.719 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -52.85 -56.09 18.36 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.812 0.339 . . . . 0.0 110.365 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.33 -41.64 93.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.777 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -58.09 -54.88 42.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.614 -177.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.823 HD11 HD13 ' A' ' 60' ' ' LEU . 35.8 mt -65.35 -35.23 74.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.862 0.363 . . . . 0.0 110.948 -177.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.435 ' HG3' ' HE1' ' A' ' 64' ' ' TYR . 3.5 ttmp? -60.15 -42.52 95.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.156 0.503 . . . . 0.0 109.991 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -82.84 -18.4 40.54 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.861 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 55.7 mt -62.2 -38.42 89.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.419 0.628 . . . . 0.0 109.544 170.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 44.5 mt -84.63 -59.35 2.39 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.158 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -109.81 25.94 11.22 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -171.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -126.19 68.57 0.52 Allowed Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 119.801 -1.19 . . . . 0.0 113.75 -175.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -135.04 120.27 18.92 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.132 0.492 . . . . 0.0 110.558 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -86.01 74.58 10.09 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.369 0.604 . . . . 0.0 111.151 -173.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -138.88 0.64 2.0 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 169.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.464 ' O ' ' HB2' ' A' ' 151' ' ' HIS . 10.9 t-80 -178.25 -65.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.236 -1.347 . . . . 0.0 108.346 -175.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 52.9 t-80 166.15 -43.5 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 . . . . . 0 C--O 1.25 1.108 0 CA-C-N 113.396 -1.729 . . . . 0.0 107.474 170.144 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.601 0.239 . . . . 0.0 110.785 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.0 t -85.19 -64.47 1.15 Allowed 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.1 tp -79.1 86.47 4.92 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 174.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -107.96 99.75 9.17 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.9 tp -118.83 99.61 51.13 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.555 -175.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -73.95 178.58 6.68 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.688 2.259 . . . . 0.0 112.526 -178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -110.98 95.98 5.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.896 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -141.92 176.45 8.93 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.472 -175.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -77.07 -174.64 3.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.355 -177.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.564 ' O ' ' HB3' ' A' ' 11' ' ' LYS . 50.6 mm -55.28 130.85 17.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 173.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.564 ' HB3' ' O ' ' A' ' 10' ' ' ILE . 38.8 tttm 76.18 77.92 0.09 Allowed 'General case' 0 N--CA 1.465 0.286 0 O-C-N 124.021 0.826 . . . . 0.0 109.851 -171.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 9' ' ' LYS . 0.5 OUTLIER -96.21 -161.37 0.86 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.804 178.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 62.25 12.46 5.18 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.19 174.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.6 m -86.2 2.17 47.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.254 0.55 . . . . 0.0 110.478 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.9 tp -159.96 139.57 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.991 -179.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.42 ' N ' HD13 ' A' ' 16' ' ' ILE . 4.1 mp -94.39 102.73 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 168.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.92 132.47 44.4 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.4 mt -113.61 105.54 18.94 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.25 -176.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.417 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.0 OUTLIER -93.88 101.44 13.52 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.267 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.492 ' HB2' HG11 ' A' ' 95' ' ' VAL . 78.4 mt -137.54 155.66 48.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.4 mtmt -89.0 137.99 31.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.495 0.664 . . . . 0.0 111.425 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.592 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -87.64 -169.89 2.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.87 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.676 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 36.5 tp -48.33 -39.52 22.27 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.603 0.761 . . . . 0.0 112.716 -178.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.9 mtmm -74.98 -13.6 60.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.999 0.428 . . . . 0.0 111.738 -177.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.63 17.25 55.17 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 -175.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.464 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.9 OUTLIER -99.56 127.56 45.64 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.667 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.548 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.5 m -67.97 113.78 5.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.454 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 16.5 mmm180 -92.45 142.29 27.58 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.428 ' O ' ' HB3' ' A' ' 32' ' ' ASP . 2.0 m -134.31 163.66 29.15 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 174.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.481 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 65.4 mt -80.08 -32.88 39.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.553 -172.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.7 p -64.21 -14.32 54.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.018 0.437 . . . . 0.0 111.116 173.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t0 -82.6 -45.07 15.03 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -76.35 0.13 20.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.473 -1.24 . . . . 0.0 110.659 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.607 ' HB3' ' HZ2' ' A' ' 34' ' ' LYS . 7.4 ttpm? -58.26 134.58 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.736 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.69 -29.88 5.5 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -174.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.569 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 61.4 mttm -112.38 166.15 11.55 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.753 HG22 ' HD1' ' A' ' 69' ' ' PHE . 8.5 m -84.27 124.44 39.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.613 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 99.4 t -102.06 132.03 48.86 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 121.641 0.734 . . . . 0.0 111.045 -169.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.617 HD21 HG23 ' A' ' 71' ' ' ILE . 6.4 tt -94.38 104.27 16.25 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 172.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.435 HG13 ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -88.46 104.34 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.281 178.339 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.545 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.2 t70 -103.26 142.02 34.9 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.065 -175.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -124.3 95.93 4.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 173.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.429 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.7 t -123.7 -175.71 3.28 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.296 -174.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.501 ' CG1' ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -137.78 111.51 8.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.08 0.467 . . . . 0.0 110.628 178.85 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.994 ' HH ' HD11 ' A' ' 90' ' ' LEU . 41.7 m-85 -72.55 79.18 1.06 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 51.4 t30 172.51 -25.59 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.224 -177.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.501 ' HB2' ' CG1' ' A' ' 44' ' ' VAL . 5.6 t-20 -82.29 150.15 27.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.643 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.02 -30.95 62.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -71.77 -20.17 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.75 -176.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.0 m -63.97 -24.69 67.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.623 0.249 . . . . 0.0 111.329 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.05 -50.23 74.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.802 0.334 . . . . 0.0 111.269 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.61 -31.94 60.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.103 0.478 . . . . 0.0 110.814 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -63.72 -45.11 91.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.715 179.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.71 -18.78 62.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.836 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.416 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -73.85 -44.31 55.92 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.95 -37.77 77.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.395 0.616 . . . . 0.0 109.882 175.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.87 -40.31 91.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.926 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.463 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 13.1 tpt180 -56.14 -35.96 67.72 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.958 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.55 -50.96 11.49 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -172.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.915 HD12 HD13 ' A' ' 140' ' ' ILE . 1.9 mm? -55.97 -31.34 62.9 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 113.262 -1.79 . . . . 0.0 111.441 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.417 ' HD1' HG13 ' A' ' 71' ' ' ILE . 23.9 t80 -82.83 -44.03 15.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.387 0.613 . . . . 0.0 109.876 -178.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 29.1 t30 -60.65 -24.82 65.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.116 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -85.95 -60.67 1.95 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.815 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.57 -12.51 16.4 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -164.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.41 -31.77 70.7 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -174.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 m -60.35 -28.73 68.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.168 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.516 ' HG3' HD11 ' A' ' 144' ' ' LEU . 9.2 pt20 -108.68 29.77 7.12 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 99.02 48.62 1.71 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.067 -1.063 . . . . 0.0 112.852 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.753 ' HD1' HG22 ' A' ' 37' ' ' VAL . 37.3 t80 -132.23 140.5 48.7 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.413 ' OE1' HG21 ' A' ' 93' ' ' VAL . 0.3 OUTLIER -140.62 151.2 44.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.493 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.617 HG23 HD21 ' A' ' 39' ' ' LEU . 65.2 mt -114.24 111.0 34.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.714 0.769 . . . . 0.0 110.394 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.527 ' CE1' HG21 ' A' ' 95' ' ' VAL . 91.5 t80 -96.56 99.17 10.82 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.545 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 8.4 tt0 -100.96 114.35 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.349 -171.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 50.0 mt -96.71 124.6 49.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.218 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.497 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 27.9 t -96.93 137.95 35.23 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.904 0.383 . . . . 0.0 110.472 177.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 31.0 mt -112.08 34.32 4.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.653 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.404 ' OD2' ' HD3' ' A' ' 96' ' ' ARG . 3.6 p30 -82.92 -176.16 6.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.449 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.7 35.98 1.88 Allowed Glycine 0 N--CA 1.444 -0.773 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.45 176.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -145.35 115.83 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.359 0.599 . . . . 0.0 110.995 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.473 ' HA ' HH12 ' A' ' 96' ' ' ARG . 4.9 tp10 -64.65 -36.0 82.84 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.096 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -61.51 -56.38 20.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.585 -170.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -68.55 -41.05 80.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.76 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.676 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 53.2 t90 -60.81 -55.12 36.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.545 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -57.32 -46.93 82.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.899 0.381 . . . . 0.0 111.362 -176.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 21.3 m -70.2 -42.47 72.3 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.804 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.6 t -75.43 -42.38 53.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.05 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.577 ' HB3' ' SG ' ' A' ' 94' ' ' CYS . . . -64.59 -32.13 73.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.863 0.363 . . . . 0.0 110.99 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.53 -27.84 68.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.413 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.61 -1.99 42.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.528 -176.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.994 HD11 ' HH ' ' A' ' 45' ' ' TYR . 26.8 mt -96.7 148.59 34.66 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 121.171 0.51 . . . . 0.0 112.229 -176.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.583 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 89.4 Cg_endo -74.41 -51.79 0.13 Allowed 'Trans proline' 0 N--CA 1.478 0.611 0 C-N-CA 124.128 3.219 . . . . 0.0 114.423 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.583 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -83.57 -178.95 7.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.627 -172.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.413 HG21 ' OE1' ' A' ' 70' ' ' GLU . 99.1 t -70.2 125.19 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 121.294 0.568 . . . . 0.0 111.052 -173.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.577 ' SG ' ' HB3' ' A' ' 87' ' ' ALA . 1.8 p -113.97 105.21 12.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.396 -176.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.592 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 1.7 t -115.36 161.51 14.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.379 -172.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.473 HH12 ' HA ' ' A' ' 80' ' ' GLU . 46.9 ttp180 -140.49 140.12 35.25 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.255 170.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -93.94 149.33 21.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.63 175.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.65 -1.75 47.84 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -173.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -110.01 -12.49 14.53 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.106 -0.371 . . . . 0.0 111.702 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.21 -117.1 8.66 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.119 -178.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -91.63 25.15 2.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.86 0.362 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -130.22 17.27 5.52 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.419 178.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.538 ' HB2' HG13 ' A' ' 106' ' ' ILE . 10.5 m -61.96 134.55 56.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.204 -178.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.473 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 4.0 m -55.78 -35.22 66.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.012 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -57.08 -47.56 80.72 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.538 HG13 ' HB2' ' A' ' 103' ' ' SER . 68.2 mt -57.93 -37.76 62.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.928 -177.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 16.0 m -70.33 -36.19 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.898 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.5 mt -66.01 -34.87 79.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.305 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -71.44 -29.75 65.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.667 0.27 . . . . 0.0 110.853 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.7 77.68 0.29 Allowed 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -163.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.453 HG13 ' CG2' ' A' ' 106' ' ' ILE . 7.4 p -90.49 152.93 3.27 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.491 -174.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 8.6 m -72.99 -43.4 62.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 173.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.411 ' H ' HG22 ' A' ' 111' ' ' VAL . 10.4 p30 174.84 169.83 0.27 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.154 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.541 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 3.6 mm? -118.96 162.26 32.22 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.541 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.7 Cg_endo -73.36 153.5 99.17 Favored 'Cis proline' 0 C--N 1.35 0.607 0 C-N-CA 123.811 -1.329 . . . . 0.0 113.163 0.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.441 ' HB2' HD13 ' A' ' 114' ' ' LEU . 30.4 m -151.13 178.57 9.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.383 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.492 HG12 ' HA3' ' A' ' 130' ' ' GLY . 4.3 p -139.36 162.21 27.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.435 ' HB2' HG13 ' A' ' 40' ' ' ILE . 91.6 m-85 -144.27 157.17 44.42 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.862 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.7 tp -112.77 144.92 41.48 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.079 -0.248 . . . . 0.0 110.681 -177.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.613 ' CG2' ' HB ' ' A' ' 38' ' ' VAL . 5.1 m -141.67 140.5 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 120.853 0.359 . . . . 0.0 110.9 169.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.623 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 5.3 p30 -80.49 173.83 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.582 ' HG3' HG11 ' A' ' 37' ' ' VAL . 98.2 mtt180 -52.55 -30.03 28.53 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.147 1.165 . . . . 0.0 114.147 -171.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -76.79 4.93 8.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.094 0.474 . . . . 0.0 110.243 177.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.481 ' OD1' ' HB3' ' A' ' 30' ' ' LEU . 3.2 m-80 58.44 61.95 2.11 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.221 -173.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.623 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 46.1 mt-10 -124.94 132.18 53.32 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.85 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.536 ' HA ' HG13 ' A' ' 120' ' ' VAL . 1.2 tt -58.91 113.39 2.05 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 123.895 0.747 . . . . 0.0 110.504 -174.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.862 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.6 m -77.88 -55.29 5.43 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.581 -179.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.577 ' HB3' HD22 ' A' ' 132' ' ' ASN . . . -172.71 171.48 4.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.299 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.596 ' HD3' ' OE2' ' A' ' 131' ' ' GLU . 57.9 mtt180 -90.48 144.91 25.33 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.11 -178.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.492 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -64.48 -17.77 62.55 Favored Glycine 0 C--N 1.319 -0.387 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 172.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.596 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 10.9 mt-10 -64.94 -24.71 67.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.099 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.584 ' OD1' ' HB2' ' A' ' 129' ' ' ARG . 1.6 p-10 -118.49 -23.14 7.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.562 179.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 129' ' ' ARG . 70.5 mt -79.41 101.85 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.919 0.39 . . . . 0.0 110.461 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.3 ptmm? -84.76 -32.35 23.47 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -121.61 93.29 3.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.536 ' O ' HG13 ' A' ' 140' ' ' ILE . 5.8 mp -75.85 -25.52 56.29 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.228 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.577 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.1 t70 -49.37 -58.01 5.88 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 123.433 0.458 . . . . 0.0 110.931 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -60.7 -42.98 98.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.813 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.506 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -57.81 -53.1 61.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.456 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.915 HD13 HD12 ' A' ' 60' ' ' LEU . 33.7 mt -64.54 -40.56 89.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.889 0.376 . . . . 0.0 110.949 -178.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 145' ' ' GLU . 26.9 ttpp -58.92 -47.28 85.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.436 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.598 ' HA ' ' HG2' ' A' ' 145' ' ' GLU . 32.3 mtmt -68.41 -20.47 64.67 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.766 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 87.5 mt -72.8 -40.81 65.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.263 0.554 . . . . 0.0 110.239 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.516 HD11 ' HG3' ' A' ' 67' ' ' GLN . 97.6 mt -79.02 -44.04 23.04 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.334 -176.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.598 ' HG2' ' HA ' ' A' ' 142' ' ' LYS . 11.0 pt-20 -64.81 -38.06 89.73 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.99 -178.12 40.95 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.83 176.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -75.53 -23.12 56.61 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 175.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -108.94 90.75 3.39 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 172.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -51.92 107.3 0.19 Allowed 'General case' 0 N--CA 1.464 0.256 0 O-C-N 123.791 0.682 . . . . 0.0 111.673 -176.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -89.87 88.66 7.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.046 -176.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 70.39 8.92 6.81 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.288 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . 0.408 ' CE1' ' HA ' ' A' ' 145' ' ' GLU . 3.0 p80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.524 -0.751 . . . . 0.0 109.916 175.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.482 1.136 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.3 t -116.57 -150.02 0.45 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 173.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.0 tp -91.08 67.65 5.98 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 173.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.591 ' HG2' HD13 ' A' ' 5' ' ' ILE . 2.4 pt-20 -87.15 5.08 39.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.285 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.591 HD13 ' HG2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -128.06 101.63 22.44 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.778 179.195 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.504 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 11.9 Cg_exo -72.55 -132.7 0.01 OUTLIER 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.874 2.383 . . . . 0.0 112.9 174.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.5 ' OE1' ' HB3' ' A' ' 14' ' ' SER . 4.9 mm-40 62.91 32.38 15.74 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 122.229 1.014 . . . . 0.0 108.616 -172.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.406 ' OD2' ' HB2' ' A' ' 12' ' ' GLU . 7.4 p-10 -87.44 95.81 10.15 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 113.821 -1.536 . . . . 0.0 111.743 -173.188 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.45 ' O ' ' HD3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER 44.9 130.91 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 179.673 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.1 mt 52.68 -107.5 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.544 -1.207 . . . . 0.0 109.233 -171.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.527 ' HD2' ' HB2' ' A' ' 14' ' ' SER . 24.9 mmtm -156.93 83.05 0.94 Allowed 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 123.82 0.848 . . . . 0.0 110.09 172.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.406 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 61.3 mm-40 -91.86 -92.87 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.436 0.636 . . . . 0.0 111.061 -178.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.35 14.3 4.54 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.725 175.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.527 ' HB2' ' HD2' ' A' ' 11' ' ' LYS . 0.9 OUTLIER -90.21 -158.66 0.55 Allowed 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 114.701 -1.136 . . . . 0.0 109.89 -176.61 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.599 HD13 HD12 ' A' ' 30' ' ' LEU . 4.9 tp -94.87 124.36 47.34 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.306 175.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.458 ' O ' HD11 ' A' ' 30' ' ' LEU . 3.4 mp -66.55 120.04 12.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.66 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.66 107.69 4.63 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.057 0.456 . . . . 0.0 110.017 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.654 ' O ' ' HA ' ' A' ' 29' ' ' SER . 12.9 mt -106.18 110.3 30.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.872 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.511 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 95.1 mt-30 -107.47 101.4 10.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.122 0.486 . . . . 0.0 111.33 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.568 ' HB2' HG11 ' A' ' 95' ' ' VAL . 28.4 mt -137.19 157.99 45.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.689 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 47.9 mttm -94.8 158.95 15.27 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.391 0.615 . . . . 0.0 111.675 -175.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -95.44 -169.74 2.03 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.39 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.682 HD12 ' HB2' ' A' ' 87' ' ' ALA . 6.4 mp -52.97 -41.5 64.62 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.6 0.562 . . . . 0.0 111.844 -176.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.546 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 67.5 mttm -81.3 -16.62 51.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.1 -175.061 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.47 6.88 40.81 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.959 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.546 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 2.2 m-80 -80.99 126.36 31.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.689 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.3 m -74.86 112.82 11.47 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.959 0.409 . . . . 0.0 110.637 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.552 ' HG3' HG13 ' A' ' 93' ' ' VAL . 3.6 mmm-85 -100.49 143.47 30.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.654 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.2 p -127.42 175.93 7.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.278 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.599 HD12 HD13 ' A' ' 15' ' ' ILE . 97.2 mt -78.9 -10.95 59.97 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.595 ' HA ' ' HB2' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -88.46 2.27 53.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.334 169.524 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 29' ' ' SER . 29.1 t70 -95.94 -33.51 12.15 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.894 HD12 HG21 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -111.47 18.24 19.33 Favored 'General case' 0 C--O 1.249 1.073 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.762 173.298 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.595 ' HB2' ' HA ' ' A' ' 31' ' ' THR . 56.4 tttp -70.93 66.64 0.38 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.202 179.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.41 -23.63 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.032 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.863 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.734 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -137.76 -174.41 3.77 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.95 174.62 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.698 HG21 ' H ' ' A' ' 122' ' ' ARG . 54.6 t -72.17 118.27 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -176.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.894 HG21 HD12 ' A' ' 33' ' ' LEU . 78.0 t -117.55 132.46 67.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-O 122.038 0.923 . . . . 0.0 113.257 -168.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.553 ' HB3' HG21 ' A' ' 71' ' ' ILE . 2.2 tt -81.14 123.49 28.47 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.274 171.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.559 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 5.6 mm -99.42 105.54 17.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 173.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.472 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 16.5 t70 -108.55 132.69 53.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.025 0.44 . . . . 0.0 111.582 -175.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.613 ' HB3' HD22 ' A' ' 114' ' ' LEU . 62.8 m-85 -121.64 109.82 15.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.529 174.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 t -150.06 176.82 10.45 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.637 HG22 ' HB2' ' A' ' 47' ' ' ASN . 17.8 m -119.59 113.27 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.64 175.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.821 ' CD1' ' HB2' ' A' ' 75' ' ' SER . 33.6 m-85 -67.72 84.77 0.2 Allowed 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.673 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.402 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 57.2 t30 174.04 -35.65 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.098 0.951 . . . . 0.0 109.228 -172.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.637 ' HB2' HG22 ' A' ' 44' ' ' VAL . 9.4 t-20 -85.07 143.09 29.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.265 -172.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.55 69.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.367 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.8 mtp -65.56 -24.33 67.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.184 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -81.47 -23.87 37.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.562 -176.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.58 -56.9 14.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.844 0.354 . . . . 0.0 110.827 -178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.78 -27.46 65.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.587 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.6 t60 -66.7 -45.64 78.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.614 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.49 ' HA ' HD11 ' A' ' 57' ' ' LEU . 5.4 m-20 -67.05 -27.91 67.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.23 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -61.13 -56.22 23.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.133 0.492 . . . . 0.0 109.896 176.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.418 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . -59.43 -33.38 71.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.021 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 96.3 mt -63.34 -40.8 98.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 110.136 176.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.867 HH21 ' HD3' ' A' ' 91' ' ' PRO . 14.5 ttm180 -64.89 -29.94 70.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.048 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -74.01 -51.82 14.69 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.448 ' CD1' ' HB3' ' A' ' 136' ' ' LEU . 22.7 mt -55.71 -35.91 66.6 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 111.742 -2.481 . . . . 0.0 111.336 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -73.02 -48.36 36.93 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.684 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -62.56 -22.35 66.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.637 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -79.32 -57.65 3.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.135 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.435 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 84.7 m-85 -112.6 -8.68 13.81 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -164.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.539 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.48 -43.0 83.74 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -173.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.4 m -67.84 -16.23 64.0 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.755 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.435 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.1 mp0 -93.88 -0.53 55.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 110.736 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.69 50.6 0.52 Allowed Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.498 -0.858 . . . . 0.0 111.814 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.539 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 80.8 t80 -130.45 136.14 48.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.122 0.487 . . . . 0.0 110.749 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.734 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.5 tp10 -135.7 159.94 40.08 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.461 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.553 HG21 ' HB3' ' A' ' 39' ' ' LEU . 48.5 mt -131.0 130.15 63.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.007 0.432 . . . . 0.0 110.231 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.815 ' HB2' HD21 ' A' ' 33' ' ' LEU . 77.1 t80 -117.79 101.17 8.1 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.472 ' HG3' ' HB3' ' A' ' 41' ' ' ASP . 57.8 tt0 -105.8 121.52 44.21 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.303 -172.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.403 HD11 ' HE2' ' A' ' 72' ' ' TYR . 60.0 mt -101.88 130.31 51.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.421 -178.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.821 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 35.7 t -102.99 112.33 25.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.128 172.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.787 HD12 HD23 ' A' ' 114' ' ' LEU . 2.3 pp -113.22 28.47 8.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.89 0.376 . . . . 0.0 111.201 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.518 ' HB2' ' HB ' ' A' ' 44' ' ' VAL . 19.0 t70 -65.89 -73.91 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.319 176.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.35 -27.58 1.68 Allowed Glycine 0 N--CA 1.44 -1.041 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.892 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -85.67 131.34 34.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.24 0.543 . . . . 0.0 111.572 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -79.14 -38.97 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.52 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -68.96 -39.97 79.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.858 -165.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -77.97 -34.73 50.84 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 -176.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.574 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 22.7 t90 -62.19 -57.6 10.89 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.604 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -64.54 -38.91 92.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.928 -0.309 . . . . 0.0 111.691 -171.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -67.18 -43.53 81.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.999 0.428 . . . . 0.0 110.977 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.559 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.9 m -70.55 -24.37 62.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.811 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.682 ' HB2' HD12 ' A' ' 23' ' ' LEU . . . -87.8 -25.66 23.24 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.506 0.669 . . . . 0.0 110.099 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.3 -13.63 62.24 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.572 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -103.36 -3.49 25.45 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.832 174.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 86' ' ' SER . 41.4 mt -94.03 148.94 36.1 Favored Pre-proline 0 N--CA 1.447 -0.622 0 CA-C-O 121.361 0.6 . . . . 0.0 111.649 -175.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.867 ' HD3' HH21 ' A' ' 58' ' ' ARG . 24.7 Cg_endo -90.54 -37.95 0.05 OUTLIER 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 124.156 3.237 . . . . 0.0 113.875 -173.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.616 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.8 p90 -87.57 -169.05 2.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.206 -171.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.552 HG13 ' HG3' ' A' ' 28' ' ' ARG . 38.0 t -78.89 99.39 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-O 121.087 0.47 . . . . 0.0 110.112 -173.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.575 ' HB2' HD12 ' A' ' 23' ' ' LEU . 22.1 m -97.57 113.19 24.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.603 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.608 HG23 ' CE1' ' A' ' 72' ' ' TYR . 1.9 t -119.45 153.19 22.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.511 -170.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.455 ' HB2' ' CE2' ' A' ' 83' ' ' TRP . 7.8 tmm_? -124.02 140.0 53.4 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.433 ' HA ' HD11 ' A' ' 20' ' ' LEU . 16.1 t70 -81.92 158.61 23.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 -173.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.36 -34.53 31.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.028 -175.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.32 -12.66 8.59 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.159 -174.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 80.27 -120.17 5.12 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.688 175.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.09 -6.17 32.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 111.55 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -104.15 16.97 25.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.133 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.499 ' HB3' HG13 ' A' ' 106' ' ' ILE . 24.2 t -65.08 133.1 50.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.49 -178.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.475 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 12.0 m -62.53 -26.91 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.186 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.434 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 88.5 m-85 -63.53 -42.63 98.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.982 0.42 . . . . 0.0 110.019 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.796 HG21 HG21 ' A' ' 111' ' ' VAL . 52.3 mt -52.94 -42.27 43.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.999 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.8 m -71.93 -20.39 61.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.341 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 104' ' ' SER . 97.6 mt -81.2 -38.48 26.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.661 0.267 . . . . 0.0 111.406 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.577 ' HB2' HG23 ' A' ' 111' ' ' VAL . 77.3 m-85 -79.55 -25.21 41.72 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.882 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 90.12 23.2 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.796 HG21 HG21 ' A' ' 106' ' ' ILE . 3.3 m -85.14 148.02 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.268 -1.787 . . . . 0.0 109.691 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 9.0 t -155.1 20.54 0.43 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.943 0.401 . . . . 0.0 111.07 -177.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -146.01 -62.0 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.949 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.787 HD23 HD12 ' A' ' 76' ' ' LEU . 2.4 mp 69.95 169.77 0.11 Allowed Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.473 -177.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.486 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 3.9 Cg_exo -72.38 166.86 79.03 Favored 'Cis proline' 0 C--N 1.353 0.801 0 C-N-CA 123.712 -1.37 . . . . 0.0 111.914 -0.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.4 m -145.17 157.32 44.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.89 -177.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.542 ' O ' ' HA3' ' A' ' 130' ' ' GLY . 1.3 p -134.98 155.43 38.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.559 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 89.7 m-85 -145.56 153.57 41.23 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.813 ' HB3' ' HB3' ' A' ' 127' ' ' SER . 8.5 tp -122.07 150.35 42.26 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.488 -1.285 . . . . 0.0 112.217 -178.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.54 HG12 ' HA ' ' A' ' 126' ' ' LEU . 13.7 m -136.93 143.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.749 169.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.571 ' ND2' ' HG3' ' A' ' 125' ' ' GLU . 5.0 p30 -110.48 153.79 24.55 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.698 ' H ' HG21 ' A' ' 37' ' ' VAL . 21.4 ttp-105 49.8 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.785 1.303 . . . . 0.0 113.173 167.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -97.56 30.54 2.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.768 -176.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.566 ' CB ' ' HG3' ' A' ' 34' ' ' LYS . 1.2 t-20 58.68 53.88 5.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.998 -178.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.571 ' HG3' ' ND2' ' A' ' 121' ' ' ASN . 1.6 pt-20 -109.08 128.73 55.24 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.379 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.54 ' HA ' HG12 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -52.07 116.4 2.17 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.688 0.618 . . . . 0.0 111.192 -173.619 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.813 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 24.8 t -71.76 -61.56 1.74 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.663 178.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.11 164.34 18.04 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.771 179.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.537 ' HB3' ' OE1' ' A' ' 131' ' ' GLU . 7.3 mmm180 -75.37 147.5 39.98 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 1.037 ' HA2' HG12 ' A' ' 133' ' ' ILE . . . -67.33 -21.74 72.43 Favored Glycine 0 CA--C 1.508 -0.385 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.985 -175.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.537 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.9 mp0 -67.1 -12.39 59.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.361 0.601 . . . . 0.0 109.547 173.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -117.62 -1.53 11.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.163 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 1.037 HG12 ' HA2' ' A' ' 130' ' ' GLY . 16.5 mm -84.39 94.79 3.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.402 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 14.7 ptmm? -50.27 -51.78 41.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.383 0.611 . . . . 0.0 110.206 176.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.402 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 4.8 m-20 -144.35 126.64 15.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.937 HD22 HG23 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.85 -38.86 79.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.408 ' HB2' HD23 ' A' ' 60' ' ' LEU . 9.5 t70 -49.09 -58.42 4.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.771 176.064 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.01 -40.96 70.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.414 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.612 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.914 -175.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.702 HD12 HD13 ' A' ' 136' ' ' LEU . 24.1 mt -60.64 -46.08 96.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.691 0.758 . . . . 0.0 110.037 176.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.44 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 17.2 ttpt -56.99 -39.09 74.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.559 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.585 ' HE3' ' HA ' ' A' ' 139' ' ' ALA . 17.9 pttp -84.39 -19.94 32.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.526 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 13.8 mt -81.52 -29.56 33.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -175.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 87.0 mt -52.64 -42.14 64.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.356 0.598 . . . . 0.0 110.179 178.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.674 ' HB3' ' CD2' ' A' ' 151' ' ' HIS . 18.7 mm-40 -86.46 15.06 5.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.916 178.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.52 -63.13 1.48 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.64 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 77.41 -6.95 1.92 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.021 0.928 . . . . 0.0 112.715 171.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 8.0 p80 -126.81 105.88 8.96 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.823 -0.751 . . . . 0.0 111.617 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 81.8 t60 70.92 -9.2 0.86 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.461 174.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -157.09 144.39 18.74 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.674 ' CD2' ' HB3' ' A' ' 145' ' ' GLU . 0.2 OUTLIER -92.1 -93.28 0.15 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 175.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . 0.454 ' H ' ' HB3' ' A' ' 151' ' ' HIS . 4.5 p-80 . . . . . 0 C--O 1.244 0.771 0 CA-C-O 118.315 -0.85 . . . . 0.0 108.916 173.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.485 0.183 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.5 m -160.14 -78.49 0.06 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.81 0.338 . . . . 0.0 111.071 -177.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -125.82 43.15 3.14 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.522 -173.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -84.15 18.11 2.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.849 0.356 . . . . 0.0 111.008 177.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 22.6 pt -66.9 117.44 45.44 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.412 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.466 ' HD2' ' OE1' ' A' ' 7' ' ' GLU . 84.0 Cg_endo -81.97 4.97 6.63 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.493 2.129 . . . . 0.0 114.406 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.466 ' OE1' ' HD2' ' A' ' 6' ' ' PRO . 2.9 pm0 -85.67 46.07 1.27 Allowed 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 121.26 0.552 . . . . 0.0 110.539 177.156 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.567 ' CG ' ' HZ2' ' A' ' 9' ' ' LYS . 38.3 t70 -76.27 80.68 3.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.987 -177.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.567 ' HZ2' ' CG ' ' A' ' 8' ' ' ASP . 3.7 mppt? 62.37 -172.0 0.16 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.97 -1.014 . . . . 0.0 112.373 176.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.0 mt 64.9 -100.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.888 176.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.606 ' HD2' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -157.07 8.12 0.18 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.944 0.878 . . . . 0.0 109.289 -175.746 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' A' ' 7' ' ' GLU . 14.3 mm-40 -80.84 147.18 30.53 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.048 -168.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.34 -99.42 0.1 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.35 -171.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m 60.6 17.04 7.06 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.255 0.55 . . . . 0.0 111.449 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.614 HG22 ' O ' ' A' ' 124' ' ' ASN . 9.0 pt -93.66 177.27 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.116 -178.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.447 HG21 ' HD1' ' A' ' 105' ' ' TYR . 63.9 mt -111.2 104.59 17.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.1 107.38 8.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.475 0.655 . . . . 0.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.601 ' O ' ' HA ' ' A' ' 29' ' ' SER . 28.4 mm -83.38 126.0 40.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.622 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.636 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 38.5 mt-30 -129.45 95.27 3.97 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.822 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.533 HD21 ' O ' ' A' ' 19' ' ' GLN . 1.1 mm? -129.58 159.95 34.79 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.198 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.5 mtmt -85.68 143.8 28.18 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.093 0.473 . . . . 0.0 110.453 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.479 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 23.2 p30 -80.72 -171.13 2.97 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.457 -178.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.651 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 3.3 tm? -50.51 -41.27 53.3 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.187 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.41 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 74.1 mmtt -75.73 -41.63 52.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.986 0.422 . . . . 0.0 110.977 -179.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 15.65 2.42 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.645 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.452 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 26.3 m-80 -87.92 118.05 27.2 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.8 m -64.59 107.52 1.42 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.201 0.524 . . . . 0.0 110.032 177.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.636 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 9.4 mmt180 -92.26 135.41 34.03 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.505 176.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.601 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 69.8 p -112.78 158.23 20.37 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 169.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.439 HD21 HG13 ' A' ' 38' ' ' VAL . 81.9 mt -68.1 -28.43 67.34 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.586 ' HA ' ' OD1' ' A' ' 124' ' ' ASN . 5.8 p -66.56 -17.14 64.65 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.037 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -81.85 -23.14 36.58 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.846 0.831 . . . . 0.0 109.171 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.616 HD23 HG12 ' A' ' 38' ' ' VAL . 2.4 tp -96.57 2.1 51.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.119 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -57.23 112.69 1.45 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.961 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.2 -41.97 1.12 Allowed Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.542 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 60.7 mttp -100.53 171.04 7.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.687 HG22 ' HD1' ' A' ' 69' ' ' PHE . 11.5 m -81.92 124.65 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 170.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.616 HG12 HD23 ' A' ' 33' ' ' LEU . 47.5 t -101.64 120.06 50.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.743 -170.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.594 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.5 tp -85.94 110.1 19.21 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.591 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 26.8 mm -84.38 105.12 13.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.482 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 10.3 t70 -108.52 110.65 22.2 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.68 -177.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.547 ' HB3' HD12 ' A' ' 114' ' ' LEU . 26.3 m-85 -98.23 100.31 11.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.781 174.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.467 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -136.27 -174.78 3.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.472 -176.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.619 ' CG1' ' HB3' ' A' ' 47' ' ' ASN . 12.0 p -133.18 133.03 58.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 177.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 1.004 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 42.4 m-85 -87.67 78.83 8.4 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -176.25 -38.55 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.849 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.619 ' HB3' ' CG1' ' A' ' 44' ' ' VAL . 5.0 t30 -90.07 133.24 34.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.519 -174.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.49 -22.39 32.33 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.987 -173.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.7 mtt -56.86 -30.36 63.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.868 0.366 . . . . 0.0 110.85 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.0 t -73.06 -23.03 60.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.949 -177.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.7 -58.78 5.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.797 0.332 . . . . 0.0 111.167 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.61 -31.42 68.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.26 0.552 . . . . 0.0 110.457 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.419 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.3 t60 -60.01 -41.7 92.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.726 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.587 ' HA ' HD11 ' A' ' 57' ' ' LEU . 5.2 m-20 -71.29 -20.91 62.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.795 -179.101 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.7 tt -72.47 -43.32 63.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.93 -37.35 82.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.384 0.612 . . . . 0.0 110.041 175.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.587 HD11 ' HA ' ' A' ' 54' ' ' ASN . 91.0 mt -65.19 -41.43 94.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.805 176.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -57.49 -32.06 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.84 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.68 -55.44 5.65 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.802 HD13 HD11 ' A' ' 140' ' ' ILE . 2.0 mm? -55.61 -32.41 63.08 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.757 -2.019 . . . . 0.0 111.23 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -74.47 -47.86 30.87 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.223 0.535 . . . . 0.0 109.852 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.65 -20.75 66.48 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.685 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -78.82 -60.46 2.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.989 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.509 ' HB3' HD13 ' A' ' 144' ' ' LEU . 92.3 m-85 -114.29 -5.93 12.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 113.939 1.089 . . . . 0.0 113.939 -164.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -55.36 -38.05 68.31 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.299 0.499 . . . . 0.0 111.964 -175.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.2 p -66.65 -16.38 64.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.031 -176.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.443 ' HB2' HD12 ' A' ' 144' ' ' LEU . 3.6 mm-40 -96.65 4.45 51.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.793 0.33 . . . . 0.0 110.758 -174.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.87 45.78 1.25 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.622 -176.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.687 ' HD1' HG22 ' A' ' 37' ' ' VAL . 41.9 t80 -125.96 135.34 51.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.748 0.309 . . . . 0.0 110.3 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -140.43 147.5 39.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.971 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.523 HD11 ' CE3' ' A' ' 92' ' ' TRP . 55.8 mt -107.97 129.91 61.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.044 0.45 . . . . 0.0 110.082 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.427 ' HH ' HG23 ' A' ' 95' ' ' VAL . 83.1 t80 -110.8 99.83 8.68 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.482 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 19.3 tt0 -100.59 123.3 44.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.929 -173.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.407 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 27.6 mt -110.38 127.22 67.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.302 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 1.004 ' HB3' ' HD1' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -84.97 141.52 30.29 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.177 0.298 . . . . 0.0 110.301 172.3 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.519 ' HB3' ' HA3' ' A' ' 100' ' ' GLY . 47.3 mt -96.0 -3.46 44.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 111.058 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.459 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 5.8 p-10 -90.36 -170.57 2.79 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.433 -174.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -136.47 29.18 2.81 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 173.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.33 125.88 41.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.882 0.372 . . . . 0.0 110.237 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.2 -43.87 23.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.66 -177.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.7 p80 -69.05 -42.95 75.61 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.162 -166.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -79.12 -38.23 36.63 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.278 -177.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.651 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 31.5 t90 -61.64 -51.25 69.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.06 0.457 . . . . 0.0 109.979 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.524 ' HA ' HD23 ' A' ' 23' ' ' LEU . 50.2 tttm -63.08 -52.85 61.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.219 -175.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.7 m -59.1 -35.17 72.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.995 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.473 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 24.2 t -85.17 -43.29 13.96 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.262 -178.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.579 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -80.67 -25.1 38.45 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -171.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -57.9 -31.86 67.16 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.824 0.345 . . . . 0.0 111.837 -175.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -109.29 13.98 24.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.467 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 86' ' ' SER . 17.9 mt -76.95 148.71 79.22 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.281 0.562 . . . . 0.0 111.937 -177.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.658 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -73.21 -41.5 1.26 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.648 2.899 . . . . 0.0 113.233 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.658 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.1 p90 -95.35 -171.72 2.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.837 0.351 . . . . 0.0 111.466 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.8 t -82.94 132.99 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.152 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.579 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 3.9 p -130.93 110.6 11.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -176.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.479 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 15.6 m -123.53 162.02 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.411 ' O ' HD11 ' A' ' 20' ' ' LEU . 52.4 ttp180 -124.03 129.87 51.63 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.136 -0.625 . . . . 0.0 112.271 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -106.5 111.29 23.78 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 171.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -71.22 -2.19 15.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.964 0.411 . . . . 0.0 111.318 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -103.35 10.05 37.63 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.23 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.519 ' HA3' ' HB3' ' A' ' 76' ' ' LEU . . . -64.26 76.14 0.06 OUTLIER Glycine 0 CA--C 1.522 0.521 0 N-CA-C 114.425 0.53 . . . . 0.0 114.425 -173.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 168.54 -29.74 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.649 1.18 . . . . 0.0 107.974 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -126.2 14.4 7.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.946 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.519 ' HB3' HG13 ' A' ' 106' ' ' ILE . 7.4 t -70.12 135.18 48.93 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.635 -171.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.46 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 1.4 m -54.11 -33.4 57.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.03 -177.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.481 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 29.8 m-85 -68.67 -44.45 74.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.25 -175.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.519 HG13 ' HB3' ' A' ' 103' ' ' SER . 66.3 mt -53.25 -46.34 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.837 -173.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 11.2 m -67.84 -31.12 70.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.95 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.0 mt -70.28 -26.83 63.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 0.0 110.751 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.609 ' O ' ' HB3' ' A' ' 110' ' ' ASN . 84.0 m-85 -81.8 -2.68 51.71 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.121 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.609 ' HB3' ' O ' ' A' ' 109' ' ' TYR . 3.2 t30 80.77 -8.81 1.41 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.039 0.837 . . . . 0.0 109.788 -177.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.63 HG12 ' HG ' ' A' ' 114' ' ' LEU . 76.4 t -54.7 120.98 2.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.803 -1.089 . . . . 0.0 112.531 -171.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 6.3 m -89.32 -34.81 16.42 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.997 174.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -152.71 132.53 13.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.192 179.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.662 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 88.6 mt -100.02 174.8 2.75 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.846 174.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.662 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.0 Cg_endo -70.84 156.47 95.71 Favored 'Cis proline' 0 C--N 1.362 1.249 0 CA-C-N 120.77 1.311 . . . . 0.0 114.028 1.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.403 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 69.1 m -156.88 146.38 20.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.83 178.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.475 HG13 ' HA3' ' A' ' 130' ' ' GLY . 3.3 p -103.91 156.93 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.591 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 77.0 m-85 -141.09 164.97 28.84 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.968 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 10.7 tp -111.73 138.53 48.18 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.531 -175.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.447 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 4.9 t -131.13 117.79 38.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.22 0.533 . . . . 0.0 110.005 171.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -69.15 161.39 29.21 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.635 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.542 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 25.3 mtm180 -53.94 -20.69 6.49 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -171.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.53 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 56.0 t30 -83.46 5.09 25.01 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.614 ' O ' HG22 ' A' ' 15' ' ' ILE . 1.4 m120 63.64 60.68 1.07 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.664 -167.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.53 ' HG3' ' HB3' ' A' ' 123' ' ' ASN . 56.3 mt-10 -126.2 118.15 24.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.352 179.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.518 ' H ' HG23 ' A' ' 15' ' ' ILE . 0.9 OUTLIER -57.58 109.04 0.63 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.392 0.615 . . . . 0.0 109.36 176.368 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.968 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -82.43 -48.59 10.92 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.486 -172.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -175.7 172.93 2.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.286 -178.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.556 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 78.7 mtt85 -90.89 156.65 17.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.074 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.475 ' HA3' HG13 ' A' ' 117' ' ' VAL . . . -59.33 -38.58 93.55 Favored Glycine 0 C--O 1.228 -0.221 0 C-N-CA 121.521 -0.371 . . . . 0.0 112.567 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.556 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.2 OUTLIER -79.46 -19.21 50.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.46 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.53 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -86.59 -19.58 29.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.511 0.672 . . . . 0.0 109.498 179.871 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 129' ' ' ARG . 83.2 mt -92.28 123.27 44.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.562 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -57.12 -45.09 83.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.692 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.604 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 2.4 p-10 -156.61 128.66 7.36 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.567 ' O ' HG13 ' A' ' 140' ' ' ILE . 6.8 mp -75.31 -25.87 58.21 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.594 -174.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.511 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.0 t70 -50.74 -58.38 6.05 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 123.475 0.485 . . . . 0.0 109.931 174.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.604 ' HB2' ' OD2' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -55.96 -41.69 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.12 175.888 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.32 -52.61 52.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.82 -175.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.802 HD11 HD13 ' A' ' 60' ' ' LEU . 45.8 mt -59.96 -42.34 89.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.61 0.719 . . . . 0.0 109.878 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.536 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.9 ttpt -57.58 -40.03 78.1 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.331 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -84.67 -24.67 28.9 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.945 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 30.8 mt -66.45 -40.72 89.59 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-O 120.958 0.409 . . . . 0.0 110.164 175.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.509 HD13 ' HB3' ' A' ' 64' ' ' TYR . 95.9 mt -60.72 -44.17 96.95 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.948 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -69.93 -65.62 0.7 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.078 176.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.18 -74.5 1.65 Allowed Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 -167.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 65.71 21.48 11.58 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.304 0.642 . . . . 0.0 111.856 168.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -167.37 72.36 0.11 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.253 0.549 . . . . 0.0 111.434 175.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 177.7 -35.75 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 175.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 46.1 m-70 -113.66 -164.64 0.94 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 167.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 34.8 t60 -74.56 -19.68 60.24 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 166.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 . . . . . 0 C--O 1.247 0.922 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.593 172.851 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.482 1.144 0 CA-C-O 120.821 0.343 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.8 p -94.83 155.85 16.62 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.172 177.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.2 tp -82.49 75.89 9.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.402 0.62 . . . . 0.0 109.738 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -90.61 85.02 5.98 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.159 -177.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 64.9 mt -117.77 101.09 52.35 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.486 175.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -76.35 -5.49 16.22 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.769 2.313 . . . . 0.0 112.717 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -81.3 88.15 6.09 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.175 -177.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -100.1 0.12 40.09 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.894 0.855 . . . . 0.0 110.524 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.919 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 26.4 ttpp -157.49 174.76 14.89 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.74 176.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.442 ' H ' ' CG ' ' A' ' 9' ' ' LYS . 17.5 pt -64.97 -3.8 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -167.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tppp? -168.88 25.79 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.344 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.919 ' HG2' ' HB3' ' A' ' 9' ' ' LYS . 22.0 mm-40 -107.59 105.14 14.88 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.262 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.45 100.79 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 O-C-N 124.164 0.915 . . . . 0.0 111.615 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.7 t -133.27 138.16 46.33 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -177.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 tp -129.98 121.36 51.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.335 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.458 175.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.698 HD13 ' H ' ' A' ' 16' ' ' ILE . 0.2 OUTLIER -90.18 136.26 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.582 177.881 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -104.7 107.61 18.65 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.597 ' O ' ' HA ' ' A' ' 29' ' ' SER . 33.8 mt -92.47 110.53 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.252 -175.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -108.63 100.64 9.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.131 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.714 ' HB2' HG12 ' A' ' 95' ' ' VAL . 39.1 mt -139.33 166.4 24.64 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.665 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 34.2 mttm -96.5 150.26 20.82 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 121.129 0.49 . . . . 0.0 110.988 177.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.551 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.4 OUTLIER -82.55 -171.88 3.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.192 179.104 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 1.06 HD11 ' HA ' ' A' ' 88' ' ' ASP . 1.0 OUTLIER -49.28 -44.74 44.24 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.807 177.991 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -79.83 -20.41 46.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.011 -176.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.61 7.92 27.19 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.059 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -82.58 113.31 20.21 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.965 0.412 . . . . 0.0 110.377 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.665 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 24.9 m -69.76 119.86 14.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.528 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 14.8 mmm180 -110.27 138.67 46.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.773 177.049 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.597 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 12.0 p -119.39 164.27 15.97 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 174.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.542 HD21 HG13 ' A' ' 38' ' ' VAL . 33.5 mt -80.3 -34.03 37.14 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.415 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.5 p -65.05 -16.78 63.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.226 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -78.2 -37.49 45.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.865 0.841 . . . . 0.0 109.082 177.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.484 HD21 HG12 ' A' ' 38' ' ' VAL . 3.7 tp -81.44 5.65 16.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.487 -1.233 . . . . 0.0 111.427 -173.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -62.83 114.73 3.81 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.126 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.71 -39.74 1.0 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 -174.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.633 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 84.6 mttt -104.15 170.89 7.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 172.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.79 HG23 ' HD1' ' A' ' 69' ' ' PHE . 15.8 m -83.57 125.95 40.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 168.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.542 HG13 HD21 ' A' ' 30' ' ' LEU . 59.8 t -101.64 123.74 54.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.312 0.577 . . . . 0.0 111.664 -168.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.404 HD23 ' HZ ' ' A' ' 69' ' ' PHE . 12.4 tp -89.25 121.27 31.38 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.113 172.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.552 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -97.91 105.13 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.457 177.812 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.565 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 12.7 t70 -102.36 128.68 48.83 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.411 -177.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.593 ' HZ ' ' HH ' ' A' ' 109' ' ' TYR . 77.2 m-85 -121.77 97.7 5.61 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 176.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.789 ' O ' ' HA ' ' A' ' 75' ' ' SER . 31.1 m -138.66 147.41 42.81 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.758 -170.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.571 HG13 ' HG ' ' A' ' 76' ' ' LEU . 29.7 m -96.04 119.54 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 121.315 0.578 . . . . 0.0 109.998 173.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.527 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 5.5 m-85 -73.01 85.34 1.29 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.97 177.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 t30 173.94 -36.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.638 -172.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -74.04 150.87 40.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.613 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.89 -29.67 68.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -173.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.3 mtt -66.75 -20.48 65.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.601 0.239 . . . . 0.0 110.504 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.1 t -58.67 -29.17 66.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.109 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.63 -55.2 21.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.89 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.66 -30.86 64.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.518 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 82.5 t60 -69.49 -37.53 77.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -63.29 -38.62 91.88 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.282 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.13 -52.02 65.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.15 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.53 90.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.137 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 89.7 mt -62.9 -42.07 99.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.2 0.524 . . . . 0.0 109.912 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.84 -31.75 71.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.919 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.435 ' HG2' ' HE3' ' A' ' 63' ' ' LYS . 7.7 tt0 -75.94 -56.15 4.94 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 -172.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.815 HD13 HD11 ' A' ' 140' ' ' ILE . 2.1 mm? -54.69 -32.2 59.08 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.417 -2.174 . . . . 0.0 111.289 178.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -77.96 -50.62 11.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.139 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.411 HD21 ' N ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -65.14 -21.78 66.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.045 0.45 . . . . 0.0 110.865 -176.871 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.435 ' HE3' ' HG2' ' A' ' 59' ' ' GLU . 89.8 mttt -77.3 -55.08 5.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.113 177.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.561 ' HB3' HD13 ' A' ' 144' ' ' LEU . 94.0 m-85 -113.79 -9.26 13.14 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -164.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.535 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -54.56 -43.34 71.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.2 m -67.77 -18.62 64.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.824 -175.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.413 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 0.9 OUTLIER -95.45 4.8 52.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.811 -179.108 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.59 51.57 0.7 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.637 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.79 ' HD1' HG23 ' A' ' 37' ' ' VAL . 56.6 t80 -127.85 143.07 51.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.615 0.245 . . . . 0.0 110.386 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.633 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.38 147.63 38.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.134 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.449 HD11 ' CE3' ' A' ' 92' ' ' TRP . 68.3 mt -112.96 117.77 56.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.156 0.503 . . . . 0.0 110.09 175.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.479 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 81.0 t80 -100.74 99.93 10.54 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 175.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.565 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 12.0 tm0? -91.12 143.37 26.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.828 -173.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 65.5 mt -136.86 121.61 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.789 ' HA ' ' O ' ' A' ' 43' ' ' THR . 89.3 p -99.99 121.13 40.88 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 121.524 0.678 . . . . 0.0 110.973 177.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.581 HD11 HD12 ' A' ' 106' ' ' ILE . 0.6 OUTLIER -101.56 43.29 1.07 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.123 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -77.48 -169.76 1.55 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.326 -1.306 . . . . 0.0 111.648 -174.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -129.18 21.39 5.2 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.603 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.414 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 28.0 t70 -162.64 115.14 1.63 Allowed 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.304 0.573 . . . . 0.0 110.236 -177.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.527 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 18.1 tt0 -77.35 -14.33 59.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.157 -176.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . 0.414 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 56.3 m80 -68.68 -56.85 6.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.793 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -60.61 -47.86 84.35 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 120.859 0.362 . . . . 0.0 110.067 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.527 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 39.5 t90 -55.51 -52.45 63.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.506 179.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.527 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 24.9 ttmt -65.8 -47.77 73.98 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.421 -174.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.8 p -62.98 -34.96 78.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.03 0.443 . . . . 0.0 111.317 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.1 m -78.43 -48.5 15.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.452 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.604 ' HB1' HD23 ' A' ' 23' ' ' LEU . . . -88.79 -21.05 23.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -168.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 1.06 ' HA ' HD11 ' A' ' 23' ' ' LEU . 28.2 t70 -57.93 -31.12 66.51 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -168.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -101.58 16.22 26.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.34 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.53 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 25.9 mt -81.25 157.65 70.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.09 0.472 . . . . 0.0 111.745 -178.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.588 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 56.1 Cg_endo -64.24 -52.15 1.72 Allowed 'Trans proline' 0 N--CA 1.477 0.536 0 C-N-CA 124.148 3.232 . . . . 0.0 113.575 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.588 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 13.1 p90 -89.55 179.02 6.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.227 0.537 . . . . 0.0 111.668 -173.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.528 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 48.4 t -76.48 123.68 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.102 -176.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.781 ' HB2' HD12 ' A' ' 23' ' ' LEU . 62.5 m -116.98 109.08 16.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.126 0.488 . . . . 0.0 110.131 -178.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.714 HG12 ' HB2' ' A' ' 20' ' ' LEU . 11.1 t -114.73 159.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.304 -172.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.51 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 31.3 ttt180 -122.02 142.15 50.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.737 0.303 . . . . 0.0 110.579 179.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -83.6 142.72 30.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.19 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.38 -5.58 58.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -172.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.468 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 12.7 m120 -119.95 -13.73 9.0 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.051 -0.66 . . . . 0.0 112.568 -175.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.424 ' C ' ' H ' ' A' ' 102' ' ' TYR . . . 57.24 82.71 0.05 OUTLIER Glycine 0 CA--C 1.522 0.525 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.339 174.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.502 ' H ' ' HB2' ' A' ' 76' ' ' LEU . . . 74.35 -29.06 0.19 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.436 0.694 . . . . 0.0 111.556 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.424 ' H ' ' C ' ' A' ' 100' ' ' GLY . 87.9 m-85 -85.38 21.57 1.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.548 ' HB3' HG13 ' A' ' 106' ' ' ILE . 38.3 t -61.56 144.51 54.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.811 -173.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.543 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 15.9 m -72.75 -29.89 63.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.741 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -68.71 -40.7 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.445 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.581 HD12 HD11 ' A' ' 76' ' ' LEU . 74.2 mt -55.49 -34.3 34.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.834 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.5 m -80.44 -27.14 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.0 mt -68.55 -42.09 78.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.268 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.593 ' HH ' ' HZ ' ' A' ' 42' ' ' PHE . 37.2 m-85 -80.58 -20.4 43.43 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.501 178.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.548 ' C ' HD21 ' A' ' 110' ' ' ASN . 0.2 OUTLIER 62.42 67.55 0.71 Allowed 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -169.0 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.496 HG12 HD21 ' A' ' 114' ' ' LEU . 40.6 t -78.39 132.48 32.29 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.824 -176.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 20.5 p -71.02 -47.33 59.28 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.025 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -172.44 129.57 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.241 0.543 . . . . 0.0 111.132 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.496 HD21 HG12 ' A' ' 111' ' ' VAL . 3.9 mm? -80.66 158.92 70.37 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.651 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.497 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 12.5 Cg_exo -73.42 156.02 99.65 Favored 'Cis proline' 0 C--N 1.349 0.57 0 C-N-CA 123.69 -1.379 . . . . 0.0 112.418 -0.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.5 m -140.26 170.08 16.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.286 -177.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.35 155.75 16.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.836 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.577 ' HE2' ' HD2' ' A' ' 129' ' ' ARG . 90.2 m-85 -138.1 157.73 45.75 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.678 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -111.46 141.85 44.49 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -177.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.516 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 6.8 t -138.7 129.4 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 174.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.633 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 4.6 p30 -85.45 170.61 12.51 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.063 178.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.51 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 13.4 ptt180 -52.72 -23.2 6.26 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -170.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -81.61 3.29 25.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.733 0.302 . . . . 0.0 110.24 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 65.93 53.28 1.13 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.598 -171.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.633 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 41.3 mt-10 -124.73 137.66 54.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.916 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 4.2 tt -68.18 109.31 3.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.318 0.58 . . . . 0.0 109.606 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.678 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 23.4 m -71.55 -57.84 4.04 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.237 -177.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.01 171.83 15.93 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.78 -175.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.577 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -98.75 146.06 26.29 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.783 -178.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -50.39 -26.69 10.09 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 121.528 -0.367 . . . . 0.0 113.041 178.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.77 -44.06 94.53 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.978 0.511 . . . . 0.0 111.592 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -104.51 -6.63 20.44 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -170.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.797 HG23 ' HG ' ' A' ' 136' ' ' LEU . 80.2 mt -76.57 100.44 2.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.193 0.52 . . . . 0.0 109.855 175.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.55 -50.07 75.0 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.044 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -139.59 109.07 6.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.978 -177.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.797 ' HG ' HG23 ' A' ' 133' ' ' ILE . 5.7 mp -70.46 -37.4 74.29 Favored 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.424 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.465 ' HA ' HD12 ' A' ' 60' ' ' LEU . 9.6 t70 -53.2 -52.33 59.21 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.591 177.051 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -64.16 -41.55 97.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.276 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.67 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -62.99 -50.73 69.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.853 -176.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.815 HD11 HD13 ' A' ' 60' ' ' LEU . 43.1 mt -61.15 -37.03 76.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.377 0.608 . . . . 0.0 110.272 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -61.94 -41.23 97.73 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.278 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.67 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -81.4 -19.51 42.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 111.193 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 75.4 mt -74.29 -39.54 62.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.809 176.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.561 HD13 ' HB3' ' A' ' 64' ' ' TYR . 65.4 mt -63.51 -41.79 98.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.423 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.686 ' HG3' ' H ' ' A' ' 146' ' ' GLY . 0.2 OUTLIER -72.11 -82.88 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.525 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.686 ' H ' ' HG3' ' A' ' 145' ' ' GLU . . . 58.83 34.68 78.98 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.255 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -175.81 137.97 0.36 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -133.0 101.61 5.3 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -159.15 17.85 0.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 0.0 110.44 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -170.53 -74.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.177 -176.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -165.6 149.21 8.06 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 52.2 p-80 . . . . . 0 C--O 1.245 0.856 0 CA-C-O 118.608 -0.71 . . . . 0.0 109.644 175.646 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.889 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 22.9 mmt . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.2 m -59.93 -49.0 79.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.775 -177.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.405 ' HA ' HD12 ' A' ' 3' ' ' LEU . 3.9 mm? -100.9 25.21 8.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.107 0.48 . . . . 0.0 110.738 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.889 ' HB2' ' HB2' ' A' ' 1' ' ' MET . 20.5 tt0 -83.3 87.85 6.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.471 0.653 . . . . 0.0 109.378 178.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.4 mt -109.91 135.82 20.44 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.508 -174.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.407 ' HB3' ' HA ' ' A' ' 13' ' ' ALA . 53.4 Cg_exo -57.6 -129.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.525 2.816 . . . . 0.0 113.087 171.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 61.16 30.53 19.39 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.773 0.797 . . . . 0.0 109.156 -176.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -85.43 -164.11 0.96 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.725 -173.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -144.07 25.92 1.54 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.181 179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.0 mm -116.0 -20.54 5.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.684 0.754 . . . . 0.0 110.726 -177.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.433 ' HB3' ' OG ' ' A' ' 14' ' ' SER . 57.1 tttm -160.76 -10.46 0.05 OUTLIER 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.588 -175.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 64.41 109.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.484 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.749 ' HB2' ' HG2' ' A' ' 125' ' ' GLU . . . 65.0 49.3 2.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.449 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 11' ' ' LYS . 21.3 m -72.57 95.35 1.81 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.568 0.699 . . . . 0.0 111.316 -179.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.935 HG21 ' H ' ' A' ' 126' ' ' LEU . 34.5 pt -99.17 -159.77 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.533 171.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.444 ' N ' HD12 ' A' ' 16' ' ' ILE . 4.0 mp -86.41 89.71 2.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.86 115.43 9.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.694 174.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.55 HD12 ' HH ' ' A' ' 109' ' ' TYR . 7.0 mt -104.26 122.11 56.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.837 -177.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.63 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 2.2 mp0 -112.71 100.5 8.75 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.198 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.417 ' HG ' HG23 ' A' ' 18' ' ' ILE . 71.1 mt -132.81 156.19 47.58 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.618 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 97.1 mttt -82.3 138.02 34.67 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.886 0.374 . . . . 0.0 111.465 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.575 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -88.96 -167.66 1.95 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.87 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.581 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 55.4 tp -50.39 -36.86 34.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.77 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -77.74 -10.09 59.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.967 0.413 . . . . 0.0 111.805 -178.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.77 18.17 60.37 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.473 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.9 OUTLIER -100.55 123.57 44.94 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.226 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.618 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 4.7 m -64.48 115.63 5.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.468 0.651 . . . . 0.0 111.367 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.63 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.6 mmm180 -88.06 142.67 27.59 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.851 172.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.616 ' CB ' ' HG3' ' A' ' 19' ' ' GLN . 1.5 m -124.01 138.56 54.44 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.518 HD21 HG12 ' A' ' 38' ' ' VAL . 50.5 mt -63.82 -32.92 74.59 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.026 178.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.8 0.05 14.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.258 177.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -105.27 -41.95 5.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.531 0.682 . . . . 0.0 109.339 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.456 ' CD1' HG21 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -78.83 -0.16 29.48 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.427 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.518 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 24.6 ttpp -63.09 102.87 0.41 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.714 176.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.86 -30.49 0.21 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -175.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.544 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -113.63 174.2 6.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 167.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.434 HG23 ' HD1' ' A' ' 69' ' ' PHE . 21.3 m -80.93 129.26 37.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.635 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 47.6 t -101.0 116.3 44.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.193 0.52 . . . . 0.0 110.812 -171.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.562 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 14.1 tp -82.84 111.75 19.03 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.596 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 27.4 mm -83.98 105.29 13.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.579 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 16.2 t70 -108.62 130.08 55.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.791 -178.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.563 ' HB3' HD22 ' A' ' 114' ' ' LEU . 51.5 m-85 -117.69 116.25 26.68 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 173.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.549 ' O ' ' HA ' ' A' ' 75' ' ' SER . 14.7 t -149.36 -176.44 5.38 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 -178.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.613 HG12 ' HB2' ' A' ' 47' ' ' ASN . 1.7 p -131.95 117.89 35.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 176.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.546 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 28.2 m-85 -77.42 79.33 3.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 122.173 0.987 . . . . 0.0 109.329 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.504 ' HB3' HG23 ' A' ' 44' ' ' VAL . 21.3 t-20 178.1 -27.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.208 -1.815 . . . . 0.0 109.297 -177.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.613 ' HB2' HG12 ' A' ' 44' ' ' VAL . 25.3 t-20 -86.16 141.09 29.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.72 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -25.8 66.6 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.163 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 94.5 mmm -68.43 -17.41 64.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.528 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.8 t -71.99 -28.48 63.44 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.64 -55.14 38.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.23 -26.39 63.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.245 0.545 . . . . 0.0 110.831 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.423 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.6 t60 -70.21 -45.52 66.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.524 -179.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.574 ' HA ' HD12 ' A' ' 57' ' ' LEU . 8.0 m120 -64.31 -28.05 69.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.986 178.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -62.8 -55.09 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.609 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.37 74.82 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.574 HD12 ' HA ' ' A' ' 54' ' ' ASN . 90.2 mt -63.56 -41.09 98.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.067 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -61.95 -30.32 70.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.092 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.32 -51.86 12.2 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -174.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.818 HD13 HD13 ' A' ' 140' ' ' ILE . 2.4 mm? -58.05 -29.99 65.8 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 112.673 -2.058 . . . . 0.0 111.299 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -78.68 -50.35 11.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.028 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -60.6 -21.95 63.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.202 0.525 . . . . 0.0 110.613 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -79.56 -57.1 3.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.412 177.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.563 ' HH ' ' CG ' ' A' ' 137' ' ' ASP . 91.3 m-85 -112.64 -8.65 13.79 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -165.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.554 ' C ' ' H ' ' A' ' 67' ' ' GLN . . . -68.99 169.83 11.0 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.115 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.3 m 70.06 -35.04 0.3 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.744 0.652 . . . . 0.0 110.799 -174.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.554 ' H ' ' C ' ' A' ' 65' ' ' ALA . 23.1 mt-30 -82.25 16.88 1.83 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.716 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.96 18.04 14.86 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.994 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.562 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 66.8 t80 -107.61 144.49 34.57 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.544 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 8.7 tp10 -145.06 156.09 43.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.463 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.528 HD12 ' CE3' ' A' ' 92' ' ' TRP . 48.3 mt -120.26 129.49 75.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.062 0.458 . . . . 0.0 110.001 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.458 ' HH ' HG23 ' A' ' 95' ' ' VAL . 78.5 t80 -117.8 101.01 7.96 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.405 178.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.579 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 39.2 mt-30 -92.74 144.15 25.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.473 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.5 mt -123.66 116.4 48.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.329 172.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.549 ' HA ' ' O ' ' A' ' 43' ' ' THR . 62.7 p -92.11 134.51 34.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.377 . . . . 0.0 110.993 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.598 HD13 HD23 ' A' ' 114' ' ' LEU . 50.2 mt -104.65 37.35 2.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.311 0.577 . . . . 0.0 109.623 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.52 ' HA ' HG21 ' A' ' 44' ' ' VAL . 3.5 p30 -87.38 172.05 10.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.861 -173.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -125.85 34.36 3.3 Favored Glycine 0 N--CA 1.442 -0.925 0 N-CA-C 110.056 -1.217 . . . . 0.0 110.056 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -149.55 101.92 3.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.17 0.51 . . . . 0.0 109.906 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -76.57 -25.71 54.3 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.654 -174.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -74.34 -30.38 62.0 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.234 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -76.14 -47.62 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.865 174.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.581 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 59.3 t90 -56.37 -42.02 77.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.632 176.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.529 ' HA ' ' CD1' ' A' ' 23' ' ' LEU . 22.5 ttmm -67.14 -51.78 49.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.315 -179.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 m -69.36 -22.0 63.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 0.0 111.402 -175.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.481 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 22.8 t -85.08 -35.12 22.04 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.262 . . . . 0.0 110.682 178.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.531 ' HA ' HD13 ' A' ' 90' ' ' LEU . . . -79.5 -17.93 53.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.658 -176.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -50.15 -45.74 53.45 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.53 0.519 . . . . 0.0 112.116 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -100.07 14.86 29.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.331 -176.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.531 HD13 ' HA ' ' A' ' 87' ' ' ALA . 22.5 mt -88.09 144.73 34.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.38 0.609 . . . . 0.0 111.923 -176.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.651 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 59.7 Cg_endo -80.89 -38.9 0.24 Allowed 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.828 3.019 . . . . 0.0 113.687 -176.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.651 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.2 p90 -101.17 -169.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.166 -171.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.504 HG11 ' HG3' ' A' ' 28' ' ' ARG . 46.7 t -91.93 131.42 39.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.791 0.329 . . . . 0.0 110.689 -172.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 85.4 m -130.31 114.91 16.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.284 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.575 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.4 m -115.97 165.74 10.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -121.92 144.51 48.82 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.349 -179.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -89.17 157.21 18.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.35 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.1 -33.39 29.77 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -174.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.569 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 53.7 t30 -118.13 -12.21 10.05 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.499 -171.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.9 -128.26 8.5 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.657 175.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.5 4.01 5.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.569 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 20.7 m-85 -111.69 13.02 21.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.97 0.414 . . . . 0.0 109.949 178.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.2 t -64.74 137.43 57.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.443 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 14.8 m -64.36 -24.24 67.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.018 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -61.08 -46.13 91.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.958 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.533 HG23 ' CG1' ' A' ' 111' ' ' VAL . 20.9 mt -61.54 -31.23 50.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.075 -174.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 14.3 m -71.18 -23.05 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.349 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.33 -17.27 46.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.55 ' HH ' HD12 ' A' ' 18' ' ' ILE . 90.4 m-85 -89.49 -20.59 23.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.198 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 56.47 72.47 0.5 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 122.204 1.002 . . . . 0.0 108.708 -167.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.533 ' CG1' HG23 ' A' ' 106' ' ' ILE . 7.5 p -75.77 136.11 25.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.921 -178.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 4.6 m -78.65 -50.54 11.3 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.315 0.579 . . . . 0.0 109.572 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -168.59 139.06 2.49 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.36 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.598 HD23 HD13 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -99.9 154.49 37.21 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.485 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 27.4 Cg_endo -62.94 153.28 69.31 Favored 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.296 -1.127 . . . . 0.0 113.621 0.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.4 m -137.33 170.67 15.69 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.271 -177.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.5 p -142.44 153.69 18.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.596 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 64.1 m-85 -140.85 164.8 29.25 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 1.011 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 9.9 tp -110.7 134.5 52.4 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.635 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 10.3 t -125.93 117.25 48.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.421 0.629 . . . . 0.0 110.532 171.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.512 ' HA ' HD11 ' A' ' 143' ' ' LEU . 18.4 t30 -68.9 161.76 28.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.283 177.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -17.66 10.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -169.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -90.95 14.79 12.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.005 0.431 . . . . 0.0 110.17 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.518 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 1.0 OUTLIER 59.0 58.96 2.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.025 -175.182 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.749 ' HG2' ' HB2' ' A' ' 13' ' ' ALA . 32.5 mt-10 -124.22 123.77 40.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.054 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.935 ' H ' HG21 ' A' ' 15' ' ' ILE . 19.6 mt -56.52 107.21 0.36 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.417 0.627 . . . . 0.0 110.016 172.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 1.011 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 49.5 m -79.7 -42.47 24.6 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.681 -175.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 179.96 172.74 1.01 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.392 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.508 ' O ' HG13 ' A' ' 133' ' ' ILE . 86.7 mtm180 -103.59 159.25 15.76 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.909 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -47.23 -43.83 19.43 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 114.327 0.491 . . . . 0.0 114.327 -174.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -72.55 -29.68 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.095 0.474 . . . . 0.0 111.379 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.424 ' OD1' ' HB2' ' A' ' 129' ' ' ARG . 8.9 m120 -79.54 -26.44 41.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.829 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.851 HG21 ' HG ' ' A' ' 136' ' ' LEU . 78.3 mt -82.01 112.3 19.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.877 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.441 ' N ' ' HD2' ' A' ' 134' ' ' LYS . 3.3 mptp? -90.44 98.11 11.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.984 174.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.93 106.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.131 -176.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.851 ' HG ' HG21 ' A' ' 133' ' ' ILE . 6.0 mp -70.07 -25.37 63.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.518 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.563 ' CG ' ' HH ' ' A' ' 64' ' ' TYR . 10.0 t70 -50.59 -52.64 37.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.375 177.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.52 -44.14 95.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.046 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.414 ' HB2' HD23 ' A' ' 119' ' ' LEU . . . -57.83 -53.88 53.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.698 -176.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.818 HD13 HD13 ' A' ' 60' ' ' LEU . 42.4 mt -60.37 -39.96 82.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.007 0.432 . . . . 0.0 111.115 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.619 ' HZ2' ' HB2' ' A' ' 141' ' ' LYS . 3.9 ttmp? -58.5 -44.36 89.39 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.744 -178.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -78.94 -24.45 43.96 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.769 -176.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.512 HD11 ' HA ' ' A' ' 121' ' ' ASN . 27.5 mt -72.18 -38.14 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.24 0.543 . . . . 0.0 110.372 175.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.537 HD12 ' HB3' ' A' ' 64' ' ' TYR . 28.6 mt -61.48 -42.09 98.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.001 -178.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -71.15 -37.05 72.25 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.174 -175.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' A' ' 147' ' ' HIS . . . 53.21 51.51 46.43 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 121.288 -0.482 . . . . 0.0 113.36 174.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . 0.426 ' HB2' ' O ' ' A' ' 146' ' ' GLY . 71.9 m-70 73.69 -60.82 0.52 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 177.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . 0.502 ' O ' ' HB2' ' A' ' 149' ' ' HIS . 79.8 t60 -90.27 -28.36 18.85 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -167.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . 0.502 ' HB2' ' O ' ' A' ' 148' ' ' HIS . 55.9 m-70 71.33 145.55 0.07 Allowed 'General case' 0 N--CA 1.471 0.589 0 O-C-N 123.409 0.443 . . . . 0.0 110.821 -171.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -177.56 -66.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.893 178.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -83.78 -5.01 59.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.358 0.599 . . . . 0.0 109.441 175.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 . . . . . 0 C--O 1.246 0.901 0 CA-C-N 114.706 -1.134 . . . . 0.0 107.976 176.938 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mpp? . . . . . 0 N--CA 1.484 1.241 0 CA-C-O 120.767 0.318 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.2 m -92.92 98.15 11.18 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 176.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 45.1 tp -121.38 118.3 29.09 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.091 -175.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.38 -3.36 40.43 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.547 0.689 . . . . 0.0 110.981 -176.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.5 tt -127.15 122.13 22.96 Favored Pre-proline 0 C--N 1.315 -0.926 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.526 -177.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.473 ' HG2' ' H ' ' A' ' 13' ' ' ALA . 36.7 Cg_endo -64.06 171.69 7.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.038 2.492 . . . . 0.0 113.622 -175.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -117.26 -178.56 3.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.468 -176.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.401 ' OD2' ' HG3' ' A' ' 9' ' ' LYS . 4.9 p-10 -76.81 164.07 26.19 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 171.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.401 ' HG3' ' OD2' ' A' ' 8' ' ' ASP . 54.5 mttp 71.6 8.34 6.17 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.894 0.855 . . . . 0.0 109.453 -172.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.613 HG22 ' H ' ' A' ' 11' ' ' LYS . 2.5 mt -137.21 178.93 4.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 114.323 -1.308 . . . . 0.0 107.5 176.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.613 ' H ' HG22 ' A' ' 10' ' ' ILE . 4.2 mptp? -83.45 92.54 7.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.52 0.676 . . . . 0.0 109.492 176.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -80.12 139.82 36.69 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.531 -174.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.473 ' H ' ' HG2' ' A' ' 6' ' ' PRO . . . 61.83 25.57 15.39 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.436 173.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.4 p -83.77 -27.5 28.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.209 0.528 . . . . 0.0 109.988 175.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.722 HG22 ' O ' ' A' ' 124' ' ' ASN . 6.9 tt -171.07 147.49 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.254 179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.491 ' O ' HD11 ' A' ' 30' ' ' LEU . 3.9 mp -97.26 138.01 23.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -92.64 108.48 20.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.545 HD12 ' OH ' ' A' ' 109' ' ' TYR . 8.9 mt -89.47 115.4 29.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.352 -177.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -111.91 100.16 8.68 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.517 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.664 ' HB2' HG12 ' A' ' 95' ' ' VAL . 22.2 mt -136.08 162.42 32.96 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.611 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.1 mttm -90.83 147.47 23.16 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.67 0.747 . . . . 0.0 111.17 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.565 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.7 OUTLIER -84.27 -173.51 4.76 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.625 -174.036 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.843 HD11 ' HA ' ' A' ' 84' ' ' LYS . 15.0 tp -54.29 -42.73 70.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.616 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.512 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.02 -39.92 83.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.601 178.314 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.469 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 124.12 13.91 3.87 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.172 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.8 m-80 -96.7 125.44 41.16 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 122.818 -0.225 . . . . 0.0 110.536 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.611 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 7.8 m -63.33 113.6 3.32 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.407 0.622 . . . . 0.0 110.586 177.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.475 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 9.4 mmm180 -102.16 127.97 48.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.246 177.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 57.6 p -115.67 158.42 22.77 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 174.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.747 ' HB3' HD22 ' A' ' 124' ' ' ASN . 79.0 mt -74.07 -29.12 61.72 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.4 p -63.37 -22.6 66.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.569 175.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -91.13 -34.42 15.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.602 0.715 . . . . 0.0 109.724 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.649 HD13 ' HG2' ' A' ' 70' ' ' GLU . 11.9 tp -82.01 10.04 7.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.857 -177.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -64.18 -11.17 28.25 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.591 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.36 -18.46 65.38 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.1 -178.31 4.77 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.891 0.377 . . . . 0.0 110.266 177.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.676 HG23 ' HD1' ' A' ' 69' ' ' PHE . 16.6 m -85.36 126.83 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 168.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.509 HG13 HD21 ' A' ' 30' ' ' LEU . 38.7 t -101.04 129.18 52.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.27 0.557 . . . . 0.0 111.663 -167.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.743 HD11 HD22 ' A' ' 136' ' ' LEU . 12.4 tp -95.72 110.58 22.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.512 173.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.536 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.0 mm -84.77 105.78 14.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.508 ' HB3' ' NE2' ' A' ' 73' ' ' GLN . 5.6 t70 -114.04 129.82 56.59 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.898 -175.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -116.58 97.78 6.19 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.742 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 m -137.95 141.45 40.54 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.212 0.53 . . . . 0.0 111.518 -170.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.623 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.1 OUTLIER -95.63 118.22 41.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.018 -177.799 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -77.26 80.74 3.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.662 0.744 . . . . 0.0 109.708 174.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.466 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 19.7 t-20 174.35 -33.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.855 -176.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.623 ' HB2' HG13 ' A' ' 44' ' ' VAL . 8.0 t-20 -73.4 148.85 42.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.031 -176.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.43 -33.54 71.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.807 -178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.1 tpp -67.58 -26.79 66.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.061 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.7 m -60.99 -32.97 72.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.997 -175.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.69 95.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.842 0.353 . . . . 0.0 111.191 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.66 -29.49 45.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.098 0.475 . . . . 0.0 110.572 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.435 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 85.5 t60 -65.85 -42.41 90.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.819 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -66.23 -21.44 66.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.591 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.2 tm? -64.14 -54.92 26.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.416 0.627 . . . . 0.0 109.91 176.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.18 -33.11 72.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.8 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 86.8 mt -65.15 -40.45 94.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.804 176.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.1 tpt180 -59.28 -33.51 71.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.778 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.81 -55.1 6.18 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -172.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.781 HD11 HD11 ' A' ' 140' ' ' ILE . 2.0 mm? -55.2 -31.91 61.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 112.846 -1.979 . . . . 0.0 111.624 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.401 ' HD1' HG13 ' A' ' 71' ' ' ILE . 24.9 t80 -77.97 -48.8 15.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.978 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.403 ' N ' HD21 ' A' ' 62' ' ' ASN . 1.0 OUTLIER -63.79 -21.68 66.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.548 -177.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -77.36 -58.62 3.17 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.91 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.593 ' CE1' ' HG3' ' A' ' 141' ' ' LYS . 96.2 m-85 -109.14 -10.65 14.98 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -165.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.475 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -53.65 -37.87 63.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.219 0.463 . . . . 0.0 111.849 -176.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.4 m -67.64 -15.21 63.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -107.99 9.61 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 0.0 111.054 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.433 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 104.88 48.97 1.04 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.912 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.676 ' HD1' HG23 ' A' ' 37' ' ' VAL . 72.4 t80 -121.92 138.77 54.28 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.649 ' HG2' HD13 ' A' ' 33' ' ' LEU . 8.7 tp10 -138.69 146.03 41.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.287 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.416 HD11 ' CE3' ' A' ' 92' ' ' TRP . 72.2 mt -112.41 124.64 69.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.927 0.394 . . . . 0.0 110.239 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.593 ' CE1' HG22 ' A' ' 95' ' ' VAL . 89.9 t80 -104.5 100.0 9.68 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.79 ' HA ' HE21 ' A' ' 73' ' ' GLN . 0.0 OUTLIER -83.49 136.67 34.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.861 -177.691 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -125.78 108.32 19.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.742 ' HA ' ' O ' ' A' ' 43' ' ' THR . 66.5 p -83.11 126.3 32.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.309 0.576 . . . . 0.0 111.189 -175.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.444 HD21 ' H ' ' A' ' 101' ' ' ALA . 17.3 mt -102.94 39.36 1.56 Allowed 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.561 ' HA ' HG21 ' A' ' 44' ' ' VAL . 1.8 p-10 -61.42 -71.91 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.266 -170.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.41 12.25 42.3 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -170.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -163.1 100.47 0.97 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.9 -26.37 61.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.008 -171.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -74.02 -29.1 61.76 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.694 -0.803 . . . . 0.0 110.89 -174.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -71.68 -48.9 44.38 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.59 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 27.9 t90 -60.67 -47.19 87.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.293 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.843 ' HA ' HD11 ' A' ' 23' ' ' LEU . 12.2 ttmt -62.35 -45.33 93.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.639 0.257 . . . . 0.0 111.497 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -68.12 -31.23 70.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.461 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.4 p -85.58 -33.67 21.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.897 0.38 . . . . 0.0 111.651 -177.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.563 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -86.32 -18.92 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.603 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 15.1 t70 -64.12 -27.05 68.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.899 0.381 . . . . 0.0 111.789 -173.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -97.0 8.23 44.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.282 0.563 . . . . 0.0 110.419 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 87' ' ' ALA . 38.3 mt -86.89 152.21 53.32 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.179 0.514 . . . . 0.0 111.726 -177.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.557 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -72.53 -58.67 0.07 OUTLIER 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.691 2.928 . . . . 0.0 114.046 -176.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.557 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.9 p90 -83.35 -173.79 4.91 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.98 124.63 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.617 ' HA ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 m -117.94 109.47 16.54 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.664 HG12 ' HB2' ' A' ' 20' ' ' LEU . 11.3 t -115.99 156.56 17.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.814 -176.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.419 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 14.8 ttp180 -113.21 139.62 48.63 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.487 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.67 156.99 20.44 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.955 0.407 . . . . 0.0 110.065 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.417 ' C ' HD21 ' A' ' 99' ' ' ASN . . . -82.04 -29.17 32.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -175.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.417 HD21 ' C ' ' A' ' 98' ' ' ALA . 0.9 OUTLIER -114.26 -14.1 12.3 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -171.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.56 78.03 0.3 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.486 178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.444 ' H ' HD21 ' A' ' 76' ' ' LEU . . . 80.42 -31.53 0.12 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.878 0.871 . . . . 0.0 111.897 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -85.01 37.34 0.66 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.344 0.593 . . . . 0.0 110.016 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.552 ' HB3' HG13 ' A' ' 106' ' ' ILE . 22.8 t -89.7 141.95 28.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.126 -172.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.426 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 2.9 p -61.28 -38.22 85.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.178 178.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -55.35 -44.48 75.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.377 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.552 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.5 mt -64.27 -28.94 46.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.011 -176.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 27.9 m -77.8 -24.76 48.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.582 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.9 mt -71.18 -37.23 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.993 -179.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.545 ' OH ' HD12 ' A' ' 18' ' ' ILE . 93.3 m-85 -69.87 -23.14 63.22 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.292 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 59.49 69.01 0.74 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.384 1.088 . . . . 0.0 108.801 -167.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.593 HG11 HD21 ' A' ' 114' ' ' LEU . 13.1 p -79.16 153.24 4.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 113.855 -1.52 . . . . 0.0 111.045 -177.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.446 ' HB ' ' HG2' ' A' ' 131' ' ' GLU . 1.7 m -102.94 -31.16 10.37 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.428 177.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -157.18 124.17 5.13 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -175.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.638 HD12 ' OG ' ' A' ' 116' ' ' SER . 3.0 mm? -98.75 143.47 26.41 Favored Pre-proline 0 N--CA 1.469 0.486 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 170.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.449 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 24.1 Cg_exo -65.26 152.52 77.46 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 124.474 -1.052 . . . . 0.0 112.655 0.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.638 ' OG ' HD12 ' A' ' 114' ' ' LEU . 13.0 m -127.55 166.12 18.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.036 -175.05 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' A' ' 40' ' ' ILE . 7.9 p -143.28 154.56 16.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.536 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 84.4 m-85 -139.02 163.74 31.6 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 176.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.852 HD11 HD13 ' A' ' 136' ' ' LEU . 14.7 tp -110.53 135.43 51.2 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.508 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 44.9 t -133.62 125.08 49.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.754 0.312 . . . . 0.0 110.484 176.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.55 ' HB3' HD21 ' A' ' 143' ' ' LEU . 8.9 p30 -82.9 166.75 18.65 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -75.31 18.62 0.2 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -169.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.447 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 63.4 t30 -95.22 -0.86 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 166.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.747 HD22 ' HB3' ' A' ' 30' ' ' LEU . 2.4 t-20 59.78 67.21 0.9 Allowed 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.561 -165.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.1 mm-40 -137.83 141.76 40.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.326 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 47.8 mt -68.88 130.79 43.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.536 0.684 . . . . 0.0 110.729 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.827 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 73.2 m -101.63 -49.87 3.88 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.942 -177.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -164.86 164.5 20.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.859 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.418 ' O ' HG13 ' A' ' 133' ' ' ILE . 92.8 mtt180 -96.96 162.24 13.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.21 -36.37 92.3 Favored Glycine 0 C--O 1.226 -0.374 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.242 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.446 ' HG2' ' HB ' ' A' ' 112' ' ' THR . 2.7 mp0 -76.46 -1.87 29.28 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 0.0 110.736 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -112.49 -18.13 12.49 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 110.539 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.654 HG22 HD12 ' A' ' 136' ' ' LEU . 96.7 mt -88.82 110.13 20.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.3 0.572 . . . . 0.0 111.247 -175.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.654 ' HG3' ' H ' ' A' ' 135' ' ' ASP . 11.2 ptmm? -72.94 -60.07 2.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 174.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.654 ' H ' ' HG3' ' A' ' 134' ' ' LYS . 7.2 m-20 -128.06 116.67 20.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.852 HD13 HD11 ' A' ' 119' ' ' LEU . 2.9 tp -75.28 -27.25 59.31 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.293 0.568 . . . . 0.0 109.553 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -52.55 -56.29 16.28 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.608 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.465 ' CD ' ' HZ1' ' A' ' 134' ' ' LYS . 12.1 pt-20 -62.46 -48.65 78.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.033 0.444 . . . . 0.0 111.33 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.401 ' N ' ' HG3' ' A' ' 138' ' ' GLU . . . -55.95 -54.25 46.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.286 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.799 HD13 ' HG ' ' A' ' 136' ' ' LEU . 27.0 mt -63.5 -29.68 47.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.727 0.299 . . . . 0.0 111.247 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.593 ' HG3' ' CE1' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -61.8 -43.81 98.11 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 110.018 177.508 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 142' ' ' LYS . 59.5 mmtt -75.27 -19.2 59.84 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.014 -178.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.55 HD21 ' HB3' ' A' ' 121' ' ' ASN . 40.2 mt -71.82 -40.25 69.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.289 0.566 . . . . 0.0 110.506 175.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.474 HD13 ' HB3' ' A' ' 64' ' ' TYR . 95.4 mt -71.77 -43.29 65.99 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.56 -177.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 146' ' ' GLY . 12.4 pt-20 -80.98 -50.77 9.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.769 178.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.408 ' N ' ' HG3' ' A' ' 145' ' ' GLU . . . 62.89 -133.68 43.65 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.446 -0.407 . . . . 0.0 112.387 -178.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -159.67 64.83 0.37 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.796 0.807 . . . . 0.0 109.928 174.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -145.25 21.7 1.54 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.548 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . 0.425 ' O ' ' HB2' ' A' ' 150' ' ' HIS . 69.9 m80 -118.0 11.89 13.52 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.869 178.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.425 ' HB2' ' O ' ' A' ' 149' ' ' HIS . 37.6 m80 72.9 -60.83 0.52 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.039 -178.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -79.85 -23.78 41.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.308 0.575 . . . . 0.0 109.525 173.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 . . . . . 0 C--O 1.245 0.816 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 169.766 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.6 ttt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.96 0.409 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 p -83.11 -65.01 1.06 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.845 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.6 tp -116.14 114.16 24.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.82 -178.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -99.93 134.18 43.22 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.048 177.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 44.8 mm -124.28 90.06 51.24 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 120.734 0.302 . . . . 0.0 111.2 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -82.45 164.14 16.75 Favored 'Trans proline' 0 CA--C 1.512 -0.577 0 C-N-CA 122.584 2.19 . . . . 0.0 112.138 171.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -163.27 149.98 12.39 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.077 -168.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -163.04 94.46 0.83 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.044 -179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.524 ' HG2' HG13 ' A' ' 10' ' ' ILE . 4.7 ttpm? 67.36 -79.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.982 0.801 . . . . 0.0 112.848 169.028 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.524 HG13 ' HG2' ' A' ' 9' ' ' LYS . 9.7 mt -111.72 46.24 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.44 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.432 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 12.6 ttpp 57.83 36.14 26.1 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.773 0.797 . . . . 0.0 109.947 179.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -84.2 -27.77 27.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.664 -171.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.19 -7.47 42.14 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.206 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.2 m -67.58 101.63 1.04 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.489 0.661 . . . . 0.0 109.935 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.574 HG23 ' O ' ' A' ' 124' ' ' ASN . 13.5 tt -65.85 143.25 15.85 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.762 -177.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.434 HD11 ' N ' ' A' ' 16' ' ' ILE . 4.4 mp -99.31 130.65 47.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.486 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -75.85 107.51 8.08 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.526 HD11 ' OH ' ' A' ' 109' ' ' TYR . 9.2 mt -89.02 105.37 15.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.686 -172.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.662 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 76.8 mt-30 -100.12 99.95 10.73 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.522 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.8 mt -136.82 153.11 50.89 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 176.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.642 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 90.8 mttt -87.87 136.23 33.05 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.907 0.86 . . . . 0.0 112.103 -173.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.409 ' HA ' HG11 ' A' ' 95' ' ' VAL . 12.5 t70 -61.08 165.85 3.99 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.5 -1.682 . . . . 0.0 108.952 172.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.521 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER -59.43 -30.05 68.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.642 0.734 . . . . 0.0 110.143 179.083 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.501 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 36.3 mtmm -69.05 -8.54 46.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.13 176.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.39 8.06 61.49 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.406 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -97.23 111.98 23.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.7 0.286 . . . . 0.0 111.538 -176.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.642 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 52.7 m -57.93 118.47 5.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.329 0.585 . . . . 0.0 111.225 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.662 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 24.3 mmt180 -93.51 143.87 25.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.648 176.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.1 p -122.79 150.82 42.3 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 170.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.614 ' HB3' HD22 ' A' ' 124' ' ' ASN . 31.4 mt -71.03 -29.9 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.051 0.453 . . . . 0.0 109.974 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 p -61.86 -19.42 62.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.425 175.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.25 -38.34 16.41 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.724 0.773 . . . . 0.0 109.848 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.66 HD21 HG13 ' A' ' 38' ' ' VAL . 11.5 tp -78.55 -1.51 34.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.884 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.536 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 36.1 ttpt -64.77 -10.59 28.83 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.476 0.655 . . . . 0.0 111.068 179.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.11 -15.27 60.45 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.917 -0.658 . . . . 0.0 111.734 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -132.2 -179.23 5.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.416 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.508 HG22 ' HB3' ' A' ' 122' ' ' ARG . 99.7 t -84.8 128.9 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 170.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.66 HG13 HD21 ' A' ' 33' ' ' LEU . 43.6 t -106.57 122.77 60.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.292 0.568 . . . . 0.0 112.396 -162.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.615 HD13 HD23 ' A' ' 136' ' ' LEU . 13.3 tp -95.08 116.94 29.36 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.93 172.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.595 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 20.7 mm -91.4 106.34 17.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 178.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.519 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.0 t70 -107.53 141.38 39.06 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.73 0.3 . . . . 0.0 111.101 -178.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -128.46 111.84 13.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.699 174.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 t -154.84 175.09 14.18 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.937 0.399 . . . . 0.0 111.006 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.55 HG21 ' HB2' ' A' ' 47' ' ' ASN . 7.9 m -112.98 121.68 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.923 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -75.99 83.83 2.88 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 173.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 179.98 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.684 -167.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.55 ' HB2' HG21 ' A' ' 44' ' ' VAL . 2.1 t-20 -88.5 149.61 23.54 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.387 -168.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.01 -29.97 69.1 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.67 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.7 -25.55 64.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.555 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 m -67.85 -27.49 66.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.14 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.22 -54.59 38.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.63 -38.03 86.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.171 0.51 . . . . 0.0 110.568 178.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.419 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.4 t60 -61.6 -40.91 96.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.711 179.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.574 ' HA ' HD13 ' A' ' 57' ' ' LEU . 18.2 t-20 -71.33 -34.72 70.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.749 -178.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.58 -41.76 92.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.29 80.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.328 0.585 . . . . 0.0 110.205 176.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.574 HD13 ' HA ' ' A' ' 54' ' ' ASN . 58.8 mt -67.34 -39.67 85.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.663 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.471 ' HA ' ' HD3' ' A' ' 58' ' ' ARG . 3.3 tpp180 -61.31 -24.96 66.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.289 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -74.46 -56.11 5.22 Favored 'General case' 0 CA--C 1.488 -1.436 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.637 HD11 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -56.19 -29.14 60.49 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-N 111.749 -2.478 . . . . 0.0 111.11 177.146 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.411 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 37.6 t80 -76.38 -52.95 8.87 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.439 -178.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.452 ' OD1' ' HD2' ' A' ' 58' ' ' ARG . 5.9 m-20 -62.48 -22.38 66.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.171 0.51 . . . . 0.0 110.369 -178.341 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -81.19 -62.05 1.77 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.832 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.608 ' HB3' ' CD1' ' A' ' 144' ' ' LEU . 87.9 m-85 -107.76 -8.08 16.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -163.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.512 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.48 -16.89 64.46 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.706 -0.621 . . . . 0.0 111.428 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.8 m -85.56 5.6 30.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.525 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -118.41 14.83 13.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.214 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.17 43.01 3.88 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.832 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.512 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 83.3 t80 -127.91 138.81 52.79 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -177.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -145.24 141.59 28.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 0.0 109.847 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.468 HD13 ' CE3' ' A' ' 92' ' ' TRP . 56.3 mt -99.06 132.79 43.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.941 -174.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.506 ' HB2' ' CD2' ' A' ' 33' ' ' LEU . 90.1 t80 -111.02 101.43 9.99 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.067 177.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.519 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 6.1 tt0 -102.72 119.11 38.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.15 0.5 . . . . 0.0 111.399 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.42 HD12 HG22 ' A' ' 18' ' ' ILE . 69.9 mt -96.69 127.93 48.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.777 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.0 m -100.37 129.63 46.37 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.401 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.539 HD11 HD13 ' A' ' 114' ' ' LEU . 0.7 OUTLIER -123.86 22.28 8.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.075 0.464 . . . . 0.0 110.461 177.569 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.48 ' HB3' ' HB ' ' A' ' 44' ' ' VAL . 4.6 p-10 -79.09 178.68 7.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.085 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.09 30.84 5.7 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.608 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -135.64 102.49 5.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.639 . . . . 0.0 111.028 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.419 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 28.5 tt0 -69.81 -18.33 63.46 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.876 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -70.09 -59.5 2.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.931 -176.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -66.32 -36.06 81.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.502 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.521 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 33.2 t90 -57.56 -60.05 4.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.866 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.419 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 31.6 ttmt -61.17 -44.19 97.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.144 -174.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.3 m -62.41 -49.13 76.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.439 -178.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.622 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.1 t -70.82 -45.94 63.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.618 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.411 ' HB1' ' HB2' ' A' ' 94' ' ' CYS . . . -58.85 -40.58 84.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -175.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.33 -28.84 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.294 0.569 . . . . 0.0 110.611 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -96.99 7.26 47.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.306 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 86' ' ' SER . 32.3 mt -100.01 153.59 37.68 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-O 121.177 0.513 . . . . 0.0 111.837 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.596 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.6 Cg_endo -75.17 -45.32 0.28 Allowed 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 123.958 3.106 . . . . 0.0 114.005 -176.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.596 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.0 p90 -94.96 -171.04 2.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.443 . . . . 0.0 112.021 -171.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.2 t -80.05 124.83 38.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.668 -174.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.411 ' HB2' ' HB1' ' A' ' 87' ' ' ALA . 39.1 m -123.44 109.4 13.8 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.379 -179.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.409 HG11 ' HA ' ' A' ' 22' ' ' ASP . 18.6 m -122.31 161.51 23.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.885 -177.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.419 HH12 ' HB2' ' A' ' 80' ' ' GLU . 59.4 ttp180 -124.47 144.21 50.21 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.054 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.97 163.44 24.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.125 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.0 -32.82 30.39 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -177.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.52 ' HB3' ' HB2' ' A' ' 102' ' ' TYR . 64.9 m-20 -113.75 -12.41 12.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.691 0.281 . . . . 0.0 111.488 -172.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.83 -116.3 5.58 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.207 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.29 -14.34 62.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.064 0.459 . . . . 0.0 111.118 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.52 ' HB2' ' HB3' ' A' ' 99' ' ' ASN . 97.8 m-85 -96.5 19.64 11.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.369 177.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.461 ' HB3' HG13 ' A' ' 106' ' ' ILE . 45.4 t -66.79 138.99 57.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.016 -178.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.572 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.9 m -67.61 -25.84 65.95 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.281 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.495 ' HA ' HD11 ' A' ' 108' ' ' LEU . 98.0 m-85 -61.7 -42.3 98.76 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.203 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.483 HG23 ' HB ' ' A' ' 111' ' ' VAL . 67.5 mt -59.94 -32.72 50.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.841 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.2 m -76.81 -33.3 57.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.852 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -62.92 -39.5 94.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.735 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.526 ' OH ' HD11 ' A' ' 18' ' ' ILE . 68.3 m-85 -81.57 -19.42 42.04 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.438 178.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 t30 63.54 75.32 0.39 Allowed 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -166.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.483 ' HB ' HG23 ' A' ' 106' ' ' ILE . 25.1 t -98.85 132.89 43.26 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.31 -177.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 3.7 m -74.93 -44.51 48.23 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.344 179.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -170.57 133.1 0.99 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.726 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.655 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 80.0 mt -85.63 170.15 13.85 Favored Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 171.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.655 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.96 153.94 96.23 Favored 'Cis proline' 0 C--N 1.355 0.891 0 CA-C-N 120.005 1.037 . . . . 0.0 113.202 0.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 69.1 m -145.13 172.91 12.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.481 -177.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.48 HG13 ' HA3' ' A' ' 130' ' ' GLY . 2.7 p -142.31 158.75 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.595 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 95.3 m-85 -140.96 161.95 36.63 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 176.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.775 HD11 HD13 ' A' ' 136' ' ' LEU . 17.0 tp -111.05 134.56 52.55 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.175 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 16.8 t -131.1 119.07 43.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.886 0.374 . . . . 0.0 110.182 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.597 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 3.5 p30 -74.69 164.44 26.58 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.508 ' HB3' HG22 ' A' ' 37' ' ' VAL . 18.0 ptt180 -52.56 -19.19 2.12 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 124.429 1.081 . . . . 0.0 113.795 -171.494 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -84.3 11.49 8.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.068 0.461 . . . . 0.0 109.907 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.614 HD22 ' HB3' ' A' ' 30' ' ' LEU . 1.8 t-20 57.79 55.35 5.5 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.161 -176.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.597 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 31.7 mt-10 -129.06 146.74 50.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.554 178.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.3 mt -72.61 112.09 8.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.171 0.51 . . . . 0.0 111.029 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.624 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 9.9 m -74.3 -56.87 4.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.527 177.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.94 170.93 11.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.909 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.55 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 14.7 mmt180 -82.89 152.67 25.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.48 ' HA3' HG13 ' A' ' 117' ' ' VAL . . . -62.28 -34.04 87.97 Favored Glycine 0 CA--C 1.509 -0.337 0 N-CA-C 111.712 -0.555 . . . . 0.0 111.712 177.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 131' ' ' GLU . 17.8 mp0 -64.35 -28.68 69.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.682 -0.759 . . . . 0.0 110.21 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -99.47 -6.32 27.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.752 -171.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 129' ' ' ARG . 85.0 mt -102.76 108.52 24.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.182 -179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 18.5 pttp -64.17 -48.56 75.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.942 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 7.3 m-20 -127.77 107.38 9.84 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.775 HD13 HD11 ' A' ' 119' ' ' LEU . 7.3 tp -74.92 -34.6 62.14 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -178.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.605 ' HA ' HD13 ' A' ' 60' ' ' LEU . 11.5 t70 -46.93 -58.2 4.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.682 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -62.72 -45.37 93.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.562 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.7 -52.24 64.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.695 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.709 HD11 ' HG ' ' A' ' 136' ' ' LEU . 52.5 mt -57.82 -45.83 87.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 0.0 110.395 177.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 66.7 tttm -52.69 -46.52 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.934 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.644 ' HA ' ' HG2' ' A' ' 145' ' ' GLU . 34.3 mttm -71.5 -29.37 64.73 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 81.4 mt -65.22 -41.72 94.13 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.787 0.803 . . . . 0.0 109.484 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.608 ' CD1' ' HB3' ' A' ' 64' ' ' TYR . 70.8 mt -72.58 -52.2 16.5 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.879 -178.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.644 ' HG2' ' HA ' ' A' ' 142' ' ' LYS . 24.1 pt-20 -69.28 -10.19 56.69 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.909 -172.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -72.49 26.6 0.72 Allowed Glycine 0 CA--C 1.523 0.545 0 C-N-CA 120.893 -0.67 . . . . 0.0 113.137 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . 0.474 ' H ' ' C ' ' A' ' 145' ' ' GLU . 31.5 t-80 -121.85 -0.85 9.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.452 0.644 . . . . 0.0 109.575 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . 0.68 ' HB3' ' O ' ' A' ' 152' ' ' HIS . 26.0 t60 -162.3 173.77 13.73 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 -177.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 12.7 p-80 -154.22 80.78 1.12 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 119.893 1.224 . . . . 0.0 113.456 178.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -151.88 -70.96 0.16 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.904 171.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -118.6 -37.08 3.35 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . 0.68 ' O ' ' HB3' ' A' ' 148' ' ' HIS . 35.3 t60 . . . . . 0 C--O 1.24 0.576 0 CA-C-N 114.232 -1.349 . . . . 0.0 108.518 175.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.402 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.482 1.142 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 m -54.59 -42.58 71.26 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 171.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -90.58 127.34 36.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.751 164.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -141.14 137.48 32.78 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.905 0.383 . . . . 0.0 110.4 -177.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 44.2 mm -118.33 112.12 37.85 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.175 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -59.75 115.75 2.83 Favored 'Trans proline' 0 CA--C 1.517 -0.374 0 C-N-CA 123.248 2.632 . . . . 0.0 114.06 176.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.01 -89.88 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.172 -1.376 . . . . 0.0 111.424 173.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -88.02 47.37 1.49 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.149 0.5 . . . . 0.0 111.178 -176.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.426 ' C ' ' H ' ' A' ' 11' ' ' LYS . 13.7 mtmt -138.57 -164.86 1.71 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.047 -177.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 19.3 mm -71.42 4.79 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 122.126 0.965 . . . . 0.0 111.007 -176.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.426 ' H ' ' C ' ' A' ' 9' ' ' LYS . 24.0 ttmm -157.13 128.61 6.95 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.522 175.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -100.82 -161.05 0.83 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.23 68.44 0.5 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.065 0.46 . . . . 0.0 112.229 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 97.8 p -104.41 -17.8 14.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.449 0.642 . . . . 0.0 109.52 174.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.551 HD11 ' O ' ' A' ' 124' ' ' ASN . 2.4 tt -158.69 141.11 5.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.869 176.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.482 ' N ' HD12 ' A' ' 16' ' ' ILE . 3.7 mp -107.05 114.08 45.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 171.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.47 108.46 14.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.119 0.485 . . . . 0.0 109.953 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 29' ' ' SER . 7.0 mt -94.93 124.9 47.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.612 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -120.97 99.21 6.37 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.546 -177.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.456 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 43.3 mt -131.09 159.1 38.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.9 mttp -90.19 142.57 27.58 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.04 0.448 . . . . 0.0 111.904 -178.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.566 ' OD1' ' HG2' ' A' ' 24' ' ' LYS . 15.9 t70 -75.88 176.89 7.41 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.092 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.908 HD12 ' HB2' ' A' ' 87' ' ' ALA . 3.0 mm? -46.81 -39.77 12.49 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 123.608 0.763 . . . . 0.0 110.889 177.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.566 ' HG2' ' OD1' ' A' ' 22' ' ' ASP . 30.6 mmtm -60.08 -48.92 79.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.954 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 9.62 3.97 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.831 -0.907 . . . . 0.0 110.831 -176.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.425 ' OD1' ' HB3' ' A' ' 22' ' ' ASP . 2.2 p30 -103.5 130.72 50.93 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.8 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.579 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 42.2 m -70.08 128.95 38.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.206 0.527 . . . . 0.0 111.313 -178.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.539 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 15.3 mmm180 -112.18 132.99 54.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.984 175.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.468 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.7 p -121.53 163.49 18.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.785 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.463 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 73.6 mt -76.11 -28.78 57.63 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 177.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 p -67.14 -14.58 63.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.371 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.02 -32.01 19.02 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.504 ' HB3' HG22 ' A' ' 38' ' ' VAL . 4.0 mp -90.71 10.04 27.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.905 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.63 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.4 ttmm -72.86 128.25 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.137 0.494 . . . . 0.0 110.372 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.07 -20.38 9.17 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 -172.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -109.22 168.71 9.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.922 -0.639 . . . . 0.0 110.376 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.77 HG23 ' HD2' ' A' ' 122' ' ' ARG . 80.6 t -91.34 118.58 36.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 169.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.723 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 95.2 t -111.5 131.38 62.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 121.716 0.769 . . . . 0.0 112.129 -169.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.9 tt -92.27 110.0 21.39 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.159 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.639 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 3.0 mp -84.19 106.49 14.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 175.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.601 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 26.1 t0 -98.55 144.74 27.54 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.601 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.536 ' HB3' HD22 ' A' ' 114' ' ' LEU . 21.7 m-85 -133.41 105.85 7.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 175.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.9 t -154.18 155.82 35.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.148 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.506 HG11 HD21 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -96.79 118.89 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.139 172.721 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -66.71 87.77 0.13 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 170.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 177.82 -35.51 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.102 -1.408 . . . . 0.0 109.157 -168.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -89.01 142.3 27.76 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.207 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.42 -29.81 64.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.961 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.4 mmm -64.32 -20.13 65.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.602 0.239 . . . . 0.0 111.337 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.4 t -64.99 -27.16 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.31 -50.17 61.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.388 . . . . 0.0 110.598 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.36 -29.41 69.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.418 0.627 . . . . 0.0 110.314 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.552 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 62.5 t60 -68.08 -47.38 68.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.5 176.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.56 ' HA ' HD13 ' A' ' 57' ' ' LEU . 5.2 m-20 -65.37 -27.14 68.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.985 178.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.76 -53.68 54.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.407 0.622 . . . . 0.0 109.886 174.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.95 74.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.662 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.56 HD13 ' HA ' ' A' ' 54' ' ' ASN . 93.2 mt -63.92 -39.57 94.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.882 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -64.23 -26.04 68.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.728 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.568 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 5.1 tt0 -78.02 -50.46 12.06 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -177.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.406 ' HA ' ' HD2' ' A' ' 63' ' ' LYS . 19.0 mt -53.72 -34.47 58.97 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 112.448 -2.16 . . . . 0.0 111.179 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.468 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 35.5 t80 -67.67 -45.76 74.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.275 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -68.04 -21.28 65.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.998 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.568 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 60.7 mttm -85.49 -61.15 1.83 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.679 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.547 ' HB3' HD12 ' A' ' 144' ' ' LEU . 66.8 m-85 -106.27 -14.8 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -163.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.543 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.35 169.7 11.78 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.92 -177.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 24.7 m 72.82 -35.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.386 0.675 . . . . 0.0 111.46 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.447 ' H ' ' C ' ' A' ' 65' ' ' ALA . 47.6 mt-30 -81.87 11.03 5.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 110.944 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.4 47.53 1.3 Allowed Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.669 -176.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.543 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 64.5 t80 -141.43 134.65 29.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -143.55 150.05 38.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.488 HD11 ' CE3' ' A' ' 92' ' ' TRP . 58.5 mt -110.36 127.38 67.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.075 0.464 . . . . 0.0 110.299 -177.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.452 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.8 t80 -119.56 100.59 7.37 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.495 -176.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.601 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 44.1 mt-30 -93.29 117.01 29.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.234 -175.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.436 HD12 ' CE2' ' A' ' 72' ' ' TYR . 16.7 mm -86.58 113.96 25.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.651 171.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 42.2 t -105.11 111.6 24.42 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.334 0.588 . . . . 0.0 110.781 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.508 HD11 ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -102.74 39.3 1.55 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.548 177.047 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.434 ' HA ' HG13 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -50.31 -73.77 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.289 -1.323 . . . . 0.0 113.621 -173.697 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 124.94 -7.07 8.24 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 111.107 -0.797 . . . . 0.0 111.107 -172.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -142.34 119.12 11.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 20.9 tt0 -68.08 -41.74 81.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.955 -173.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 -79.9 -24.33 41.2 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -168.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -70.95 -48.83 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.56 ' CZ2' HD11 ' A' ' 23' ' ' LEU . 12.5 t90 -61.83 -47.07 86.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.891 176.238 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.896 ' HA ' HD13 ' A' ' 23' ' ' LEU . 60.3 tttt -62.13 -44.27 97.01 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.4 p -69.75 -41.09 75.67 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.91 0.386 . . . . 0.0 111.397 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.7 p -76.7 -42.79 40.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.857 -176.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.908 ' HB2' HD12 ' A' ' 23' ' ' LEU . . . -79.57 -24.63 41.96 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -171.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.4 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 24.6 t70 -71.8 -8.78 56.34 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.506 0.67 . . . . 0.0 110.442 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -101.8 9.94 40.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.119 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.854 ' HG ' ' O ' ' A' ' 87' ' ' ALA . 3.7 pp -98.44 158.2 33.03 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.968 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.732 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 32.5 Cg_endo -85.03 -3.06 9.66 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 124.062 3.174 . . . . 0.0 114.693 -172.06 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.802 ' CD1' HD11 ' A' ' 90' ' ' LEU . 2.4 p90 -122.55 -153.64 0.56 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.539 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 83.9 t -103.28 134.3 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -177.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.469 ' HB3' HD22 ' A' ' 23' ' ' LEU . 39.1 t -137.93 112.86 9.06 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.45 0.643 . . . . 0.0 109.539 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.456 ' CG2' ' HB2' ' A' ' 20' ' ' LEU . 27.4 m -114.6 148.07 17.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.896 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.467 ' HD2' ' CE3' ' A' ' 83' ' ' TRP . 36.1 ttt180 -100.24 137.49 38.61 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.92 0.391 . . . . 0.0 111.215 -174.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.405 ' CG ' ' HG ' ' A' ' 103' ' ' SER . 21.5 t70 -87.09 146.01 26.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.265 178.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.64 -28.36 30.77 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.414 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 4.8 m-20 -91.53 -13.83 31.42 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -171.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 54.84 72.75 0.5 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.451 -0.404 . . . . 0.0 113.357 176.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.491 ' N ' ' HB2' ' A' ' 76' ' ' LEU . . . 78.2 -15.81 0.72 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.721 0.808 . . . . 0.0 111.858 177.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.54 25.24 5.89 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.447 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.9 OUTLIER -66.47 135.13 53.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.116 -176.393 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.604 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 26.2 m -55.65 -36.3 66.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.517 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.55 -46.12 84.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.191 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.522 HG23 ' HB ' ' A' ' 111' ' ' VAL . 65.8 mt -57.54 -43.48 83.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.753 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -67.59 -32.25 72.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.103 176.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 104' ' ' SER . 84.9 mt -65.7 -39.71 91.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.278 -179.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.423 ' O ' ' CB ' ' A' ' 110' ' ' ASN . 65.2 m-85 -77.12 -50.96 11.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.558 175.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.423 ' CB ' ' O ' ' A' ' 109' ' ' TYR . 8.6 t30 131.98 -43.31 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 O-C-N 125.525 1.766 . . . . 0.0 108.226 -176.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.522 ' HB ' HG23 ' A' ' 106' ' ' ILE . 0.4 OUTLIER 13.39 -86.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 O-C-N 125.428 1.705 . . . . 0.0 114.178 -174.298 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' THR . . . . . 0.453 ' H ' ' HB ' ' A' ' 111' ' ' VAL . 31.1 m 70.98 -52.99 0.68 Allowed 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.76 -173.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -95.2 76.82 3.45 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 121.187 0.517 . . . . 0.0 111.985 -175.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.536 HD22 ' HB3' ' A' ' 42' ' ' PHE . 2.4 mp -74.88 162.8 71.99 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.615 168.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -73.78 159.03 98.16 Favored 'Cis proline' 0 C--N 1.35 0.646 0 C-N-CA 123.249 -1.563 . . . . 0.0 112.053 0.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.8 m -145.81 175.76 10.17 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.567 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.9 p -143.11 155.12 17.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.639 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 93.3 m-85 -133.8 155.63 49.46 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.971 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 5.1 tp -118.41 143.93 46.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.318 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.723 ' CG2' ' HB ' ' A' ' 38' ' ' VAL . 14.5 m -138.99 140.15 39.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.078 0.466 . . . . 0.0 110.115 167.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.547 ' HB3' HD21 ' A' ' 143' ' ' LEU . 1.1 p-10 -89.49 178.29 6.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.859 -176.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.77 ' HD2' HG23 ' A' ' 37' ' ' VAL . 9.8 mmm180 -38.14 -48.2 1.22 Allowed 'General case' 0 N--CA 1.481 1.115 0 O-C-N 124.808 1.318 . . . . 0.0 113.813 -171.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.49 9.5 1.04 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.453 -176.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.63 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 1.6 t-20 54.28 57.95 5.4 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 123.594 0.758 . . . . 0.0 110.305 -171.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -128.09 140.15 52.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.716 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.547 ' HA ' HG13 ' A' ' 120' ' ' VAL . 3.8 tt -62.12 121.02 12.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.681 0.753 . . . . 0.0 111.295 -170.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.971 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 68.8 m -84.92 -54.58 4.57 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.436 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.487 ' HB2' ' OD1' ' A' ' 132' ' ' ASN . . . -168.98 173.6 6.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 -174.079 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.482 ' O ' HG13 ' A' ' 133' ' ' ILE . 89.7 mtt180 -110.58 158.83 18.14 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.805 -178.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.83 -14.99 32.71 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.06 173.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.25 -28.03 62.88 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 122.469 0.308 . . . . 0.0 111.033 176.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.487 ' OD1' ' HB2' ' A' ' 128' ' ' ALA . 24.6 p30 -127.57 -7.12 5.72 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.707 HG23 ' HG ' ' A' ' 136' ' ' LEU . 89.8 mt -78.8 108.63 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.506 ' H ' ' HD2' ' A' ' 134' ' ' LYS . 0.1 OUTLIER -58.42 -51.11 71.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.797 0.808 . . . . 0.0 110.009 178.122 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.538 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 9.8 t70 -154.38 124.91 6.99 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.137 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.707 ' HG ' HG23 ' A' ' 133' ' ' ILE . 5.7 mp -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.74 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -48.55 -52.69 21.46 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 123.051 0.219 . . . . 0.0 111.409 174.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -69.66 -38.79 77.22 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.321 0.581 . . . . 0.0 111.542 -179.156 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.637 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -62.81 -53.2 57.97 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.854 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 136' ' ' LEU . 41.7 mt -62.0 -32.03 53.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.271 0.558 . . . . 0.0 110.397 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -58.8 -43.08 90.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.412 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? -84.65 -18.84 34.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.203 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 30.8 mt -73.18 -41.84 63.4 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.25 178.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.547 HD12 ' HB3' ' A' ' 64' ' ' TYR . 21.1 mt -57.15 -49.72 75.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.434 0.635 . . . . 0.0 109.72 176.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -63.4 -53.35 53.74 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 114.374 -1.284 . . . . 0.0 111.454 179.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 85.25 98.22 0.7 Allowed Glycine 0 N--CA 1.441 -1.006 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 -172.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 64.5 t60 -66.12 -17.73 64.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.557 0.218 . . . . 0.0 111.465 -175.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 45.2 t60 -110.76 3.24 18.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.707 0.765 . . . . 0.0 109.542 174.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -92.16 -30.16 16.1 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 175.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -169.45 132.32 1.23 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 167.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -57.28 116.71 3.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.615 0.722 . . . . 0.0 111.986 -172.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 . . . . . 0 C--O 1.249 1.031 0 CA-C-N 115.228 -0.896 . . . . 0.0 108.839 174.787 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.0 mtm . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 110.426 -0.212 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.7 m 65.95 17.43 10.8 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.756 0.66 . . . . 0.0 111.474 174.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 36.0 mt -140.67 134.26 30.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.814 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -145.75 93.31 2.33 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 173.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 9.6 pt -115.47 133.79 22.71 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.334 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.507 ' HG2' ' HA ' ' A' ' 14' ' ' SER . 88.3 Cg_endo -85.83 24.29 0.77 Allowed 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.761 2.307 . . . . 0.0 112.014 178.337 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -119.28 80.97 1.64 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.342 174.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.89 -84.25 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.044 -176.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -133.05 -16.01 2.53 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.677 176.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 25.6 mm -131.27 156.84 43.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 114.152 -1.385 . . . . 0.0 109.365 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -63.3 104.96 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 173.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -153.62 103.74 2.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.897 0.38 . . . . 0.0 110.876 177.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 64.93 26.38 12.79 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.214 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.507 ' HA ' ' HG2' ' A' ' 6' ' ' PRO . 7.2 m -74.69 95.39 2.84 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 121.467 0.651 . . . . 0.0 110.413 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.797 HG13 ' HG ' ' A' ' 126' ' ' LEU . 12.1 tt -166.44 157.2 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.876 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.469 ' N ' HD12 ' A' ' 16' ' ' ILE . 3.6 mp -101.5 109.03 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 172.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.438 ' HA ' HD12 ' A' ' 30' ' ' LEU . 25.8 t0 -73.51 131.97 42.36 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.502 HD13 ' HH ' ' A' ' 109' ' ' TYR . 7.3 mt -113.29 111.58 36.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.138 -175.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.549 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.2 mp0 -98.87 100.16 11.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.296 178.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.95 154.39 51.12 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 89.7 mttt -85.34 143.19 28.81 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.925 0.393 . . . . 0.0 110.854 -175.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.467 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.4 p-10 -76.68 -167.13 0.76 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.929 -178.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.63 HD11 ' HA ' ' A' ' 84' ' ' LYS . 36.9 tp -56.67 -36.32 69.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -79.66 -33.52 41.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.675 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.46 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 116.49 20.24 5.13 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.065 -177.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -95.92 114.87 26.63 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 175.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.543 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.7 m -61.99 115.49 4.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.357 0.599 . . . . 0.0 111.182 178.024 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.549 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 18.8 mmm180 -92.27 142.1 27.84 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.501 175.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.5 p -120.1 159.5 24.7 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 172.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.556 ' HB3' HD22 ' A' ' 124' ' ' ASN . 71.7 mt -80.91 -28.79 35.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.689 0.281 . . . . 0.0 111.229 -177.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.87 0.64 8.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.97 0.414 . . . . 0.0 111.241 175.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -83.45 -50.34 8.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.667 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.583 ' HG ' HG23 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -98.73 26.02 6.02 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.854 0.835 . . . . 0.0 110.277 -176.839 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.593 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 30.3 ttpt -59.47 -26.57 65.35 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 113.976 -1.465 . . . . 0.0 112.514 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -56.5 -21.72 35.8 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 116.279 -0.419 . . . . 0.0 113.866 -176.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -138.41 -169.66 2.64 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 116.859 0.329 . . . . 0.0 110.522 178.483 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.652 HG23 ' HD1' ' A' ' 69' ' ' PHE . 27.6 m -82.52 143.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 -176.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.583 HG23 ' HG ' ' A' ' 33' ' ' LEU . 21.5 t -119.98 137.89 52.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.975 -173.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.65 HD21 ' HZ ' ' A' ' 69' ' ' PHE . 12.7 tp -102.66 106.2 16.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.969 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.605 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.2 mm -84.74 106.47 14.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.573 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 5.1 t70 -108.42 135.08 50.31 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.705 0.288 . . . . 0.0 111.032 -175.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.544 ' HB3' HD11 ' A' ' 76' ' ' LEU . 59.8 m-85 -123.13 99.92 6.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.573 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 15.8 m -138.81 149.66 45.19 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.018 0.437 . . . . 0.0 111.847 -170.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.52 HG21 ' HB2' ' A' ' 47' ' ' ASN . 13.7 m -96.13 115.71 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 121.178 0.513 . . . . 0.0 110.755 176.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.518 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 36.7 m-85 -78.73 85.4 4.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.576 0.703 . . . . 0.0 109.477 176.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 178.25 -34.69 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.352 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.52 ' HB2' HG21 ' A' ' 44' ' ' VAL . 2.7 t-20 -84.04 163.45 19.89 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.698 -171.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.83 -30.4 40.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.339 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.6 tpt -62.5 -26.53 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.738 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 m -60.79 -34.13 74.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.141 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.64 -52.22 65.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.633 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.83 81.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.856 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.419 ' HE2' ' CG ' ' A' ' 41' ' ' ASP . 73.5 t60 -61.97 -51.57 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.81 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.556 ' HA ' HD11 ' A' ' 57' ' ' LEU . 5.0 m-20 -75.01 -18.01 60.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.589 -177.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.47 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 1.8 tm? -69.03 -51.34 40.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.02 -39.17 84.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.502 178.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.556 HD11 ' HA ' ' A' ' 54' ' ' ASN . 96.2 mt -60.65 -38.95 86.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.086 174.168 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.47 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 7.5 tpp180 -62.83 -27.83 69.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.563 179.128 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -78.13 -51.01 10.9 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.703 HD13 HD12 ' A' ' 140' ' ' ILE . 2.9 mm? -56.09 -32.27 63.99 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 112.735 -2.03 . . . . 0.0 111.07 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.506 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 30.5 t80 -70.21 -49.12 53.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.084 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -64.03 -21.41 66.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.654 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -84.05 -61.74 1.74 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.063 -177.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.511 ' HB3' HD12 ' A' ' 144' ' ' LEU . 84.9 m-85 -113.84 -18.2 11.86 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -166.023 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.481 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.57 161.5 29.45 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.004 -176.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.5 m 77.73 -34.76 0.2 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.529 0.732 . . . . 0.0 111.543 -177.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.416 HE21 ' HB2' ' A' ' 67' ' ' GLN . 1.6 mp0 -85.24 11.04 10.79 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.068 177.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.583 ' O ' ' HB2' ' A' ' 36' ' ' LYS . . . 121.47 27.53 1.78 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.35 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.652 ' HD1' HG23 ' A' ' 37' ' ' VAL . 56.2 t80 -134.98 130.06 35.17 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 176.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.58 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 3.0 tt0 -133.3 156.26 47.92 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.261 178.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.468 HD11 ' CE3' ' A' ' 92' ' ' TRP . 54.2 mt -120.78 131.6 72.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.391 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.459 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 66.2 t80 -121.17 101.02 7.39 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.09 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HG3' ' HB3' ' A' ' 41' ' ' ASP . 7.3 tt0 -105.91 145.76 30.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.014 0.435 . . . . 0.0 111.052 -176.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.5 mt -126.51 127.58 70.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.959 -177.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.518 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 2.6 p -85.34 121.81 28.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.962 0.41 . . . . 0.0 110.955 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.563 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 12.1 mt -110.39 9.07 23.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.387 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.478 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.0 OUTLIER -68.66 -68.71 0.38 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.05 -175.808 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.64 23.24 6.02 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -174.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -134.57 98.85 4.18 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.525 ' HG2' ' CE3' ' A' ' 83' ' ' TRP . 25.8 mt-10 -75.35 -14.47 60.48 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.677 -176.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -50.87 66.78 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.002 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -81.78 -30.48 32.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.225 -177.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.534 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 42.6 t90 -66.16 -52.0 52.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.097 175.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.63 ' HA ' HD11 ' A' ' 23' ' ' LEU . 19.1 ttmm -64.17 -43.47 95.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.934 -173.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.9 p -65.05 -43.24 92.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.666 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.419 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 38.1 t -74.46 -37.13 63.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.532 -178.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.483 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -69.91 -29.07 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -174.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.44 -23.02 66.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.305 0.574 . . . . 0.0 110.764 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -92.38 -8.18 45.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.83 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 86' ' ' SER . 34.8 mt -76.75 146.4 76.28 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.659 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 20.0 Cg_endo -91.25 -17.06 1.24 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 124.423 3.415 . . . . 0.0 113.523 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.659 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.4 p90 -115.93 -170.32 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.7 0.286 . . . . 0.0 110.94 -175.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.445 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 60.3 t -81.24 122.27 36.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.072 -176.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 49.8 t -125.8 109.31 12.39 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.957 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.467 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 17.2 m -117.63 158.75 18.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.892 -178.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.445 ' HA ' ' OG ' ' A' ' 75' ' ' SER . 19.0 ttp180 -107.91 136.23 47.97 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.139 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -80.77 155.54 26.63 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.55 -20.46 36.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.763 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.502 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 3.3 m-80 -122.19 -12.94 8.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.579 -173.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.563 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 70.97 -129.89 18.9 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.619 -0.8 . . . . 0.0 111.887 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.26 -5.63 29.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.851 0.357 . . . . 0.0 111.379 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -102.53 12.72 36.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.241 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.534 ' HB3' HG13 ' A' ' 106' ' ' ILE . 34.7 t -62.97 134.66 56.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.055 -177.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.492 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 8.0 m -61.26 -26.99 68.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.741 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.437 ' CZ ' HG23 ' A' ' 18' ' ' ILE . 64.1 m-85 -60.5 -45.09 95.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.611 178.283 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.534 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.6 mt -61.15 -36.0 69.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.508 -177.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.6 m -68.16 -35.64 78.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.724 178.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.5 mt -65.06 -35.25 80.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.439 -178.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.502 ' HH ' HD13 ' A' ' 18' ' ' ILE . 93.4 m-85 -74.24 -20.43 60.17 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.145 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.458 ' C ' HD21 ' A' ' 110' ' ' ASN . 0.2 OUTLIER 53.56 58.44 5.17 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -167.324 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.403 HG11 ' CG2' ' A' ' 106' ' ' ILE . 9.3 p -65.02 147.93 12.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.294 -1.321 . . . . 0.0 110.749 -176.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 10.5 m -86.95 -34.5 19.3 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.925 0.393 . . . . 0.0 110.927 178.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -170.42 166.19 8.54 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.675 HD23 ' HB2' ' A' ' 116' ' ' SER . 64.9 mt -142.46 159.08 59.11 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.573 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 20.4 Cg_exo -67.4 147.24 77.81 Favored 'Cis proline' 0 C--N 1.352 0.723 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.143 0.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.675 ' HB2' HD23 ' A' ' 114' ' ' LEU . 8.8 m -142.22 177.94 7.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.765 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.496 HG11 HD21 ' A' ' 136' ' ' LEU . 4.5 p -135.44 162.13 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.844 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.605 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 63.9 m-85 -138.78 160.22 40.21 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 175.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.827 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -110.44 139.0 46.08 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.473 -174.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.601 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 52.9 t -127.75 118.83 50.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.947 176.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.442 ' C ' ' H ' ' A' ' 123' ' ' ASN . 4.1 p-10 -76.75 162.63 27.52 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.987 176.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -69.78 27.82 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -167.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.442 ' H ' ' C ' ' A' ' 121' ' ' ASN . 16.8 m120 -123.84 14.44 9.29 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 174.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.593 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 2.6 t-20 53.24 61.66 3.04 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.168 -169.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 68.6 mt-10 -130.88 150.74 51.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.175 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.797 ' HG ' HG13 ' A' ' 15' ' ' ILE . 24.7 mt -72.37 119.67 16.91 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.125 0.488 . . . . 0.0 110.103 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.827 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 35.5 m -83.42 -51.26 7.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.344 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -170.02 172.78 6.31 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.02 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.502 ' O ' HG13 ' A' ' 133' ' ' ILE . 82.0 mtm180 -103.16 158.39 16.34 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.404 -176.108 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.4 -35.82 73.78 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 121.565 -0.35 . . . . 0.0 112.892 -175.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.466 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.5 pm0 -77.61 -7.08 55.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.117 178.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -105.0 -20.18 13.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.718 HG22 ' HG ' ' A' ' 136' ' ' LEU . 60.5 mt -97.49 138.86 21.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.375 -176.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.59 1.07 4.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.088 0.471 . . . . 0.0 110.032 177.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -144.87 48.93 1.3 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.51 -168.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.718 ' HG ' HG22 ' A' ' 133' ' ' ILE . 3.9 mp -56.43 -38.91 72.24 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -176.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.41 -53.33 57.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.39 . . . . 0.0 110.031 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.488 ' HA ' ' HE2' ' A' ' 141' ' ' LYS . 66.0 mm-40 -62.72 -39.56 94.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.942 175.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 1.01 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.59 -56.9 16.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.648 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.703 HD12 HD13 ' A' ' 60' ' ' LEU . 52.0 mt -56.33 -42.37 73.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.378 0.609 . . . . 0.0 110.492 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.5 ttpt -60.41 -42.43 95.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.447 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 1.01 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 36.5 pttt -80.24 -23.45 40.85 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 120.659 0.266 . . . . 0.0 111.036 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.646 ' HB3' HG12 ' A' ' 37' ' ' VAL . 82.5 mt -70.72 -40.54 72.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.715 176.321 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 90.9 mt -56.41 -53.41 57.7 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.921 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.54 -56.2 11.92 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.909 178.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 147' ' ' HIS . . . 60.57 69.06 1.4 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.463 -0.875 . . . . 0.0 111.355 -177.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . 0.478 ' HB2' ' O ' ' A' ' 146' ' ' GLY . 77.6 m-70 76.14 -57.9 0.55 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.553 0.741 . . . . 0.0 111.082 -176.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -175.11 -64.53 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.835 0.35 . . . . 0.0 111.027 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -76.86 136.83 38.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.808 0.813 . . . . 0.0 113.148 -168.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -177.06 45.16 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 113.749 -1.568 . . . . 0.0 107.15 174.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 46.4 t60 62.55 54.67 2.38 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 114.149 -1.387 . . . . 0.0 107.696 -163.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 36.8 t60 . . . . . 0 C--O 1.249 1.075 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.226 -172.668 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 pmm? . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.4 p -150.04 -73.49 0.17 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.18 0.514 . . . . 0.0 109.82 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 95.3 mt -130.76 142.87 50.43 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.226 174.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -87.12 105.11 16.96 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 61.2 mt -120.57 133.91 24.12 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.694 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.731 ' HG3' ' HB3' ' A' ' 13' ' ' ALA . 65.2 Cg_exo -48.97 159.8 0.86 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.141 2.561 . . . . 0.0 112.912 175.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -104.76 -41.36 5.68 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.727 -170.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.404 ' OD1' ' HG3' ' A' ' 9' ' ' LYS . 2.8 p30 -163.99 12.54 0.05 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.404 ' HG3' ' OD1' ' A' ' 8' ' ' ASP . 24.5 mttp -132.08 163.77 27.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.183 0.516 . . . . 0.0 110.378 178.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 pt -101.26 147.38 8.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 170.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 11' ' ' LYS . 26.1 ttpp 68.98 15.29 8.85 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.511 0.672 . . . . 0.0 110.927 177.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -95.55 -7.09 38.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.671 0.748 . . . . 0.0 109.752 175.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.731 ' HB3' ' HG3' ' A' ' 6' ' ' PRO . . . -177.42 -25.63 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.012 -1.449 . . . . 0.0 109.634 -176.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.77 -41.35 73.91 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.254 175.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.4 tp -169.15 138.03 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.122 178.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.496 HD11 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -101.16 105.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 176.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -76.11 111.07 11.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.257 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.2 mt -108.4 130.44 61.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.945 -177.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.519 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 12.8 mp0 -111.56 100.7 9.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.514 -178.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 50.4 mt -130.06 154.64 47.23 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 26' ' ' ASN . 92.8 mttt -88.79 146.57 24.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.804 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.738 ' OD2' ' HG2' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -85.45 -172.47 4.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 179.777 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.594 ' HB3' ' HZ3' ' A' ' 24' ' ' LYS . 55.3 tp -51.43 -36.51 44.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.931 177.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.738 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 25.9 mmtm -72.79 -43.13 63.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.473 0.654 . . . . 0.0 110.012 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 125.62 11.16 4.17 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.665 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.524 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 39.6 m-80 -83.43 113.33 20.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 178.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.486 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 16.1 m -64.55 107.35 1.37 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.118 0.485 . . . . 0.0 110.02 173.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.519 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 17.6 mmm180 -93.02 138.57 31.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.163 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.504 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 2.9 p -118.29 154.18 32.72 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.466 HD12 ' O ' ' A' ' 16' ' ' ILE . 82.3 mt -77.37 -30.98 54.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.853 0.358 . . . . 0.0 110.738 -176.262 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.5 t -74.89 0.24 16.27 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.141 0.496 . . . . 0.0 110.67 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -87.97 -51.23 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.424 ' O ' ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -85.17 12.38 8.02 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 122.057 0.932 . . . . 0.0 110.644 -176.455 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.43 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 25.9 ttpp -56.27 124.08 16.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.728 169.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.71 -40.12 1.17 Allowed Glycine 0 CA--C 1.495 -1.217 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -172.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.484 ' HB2' ' C ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -119.27 173.67 6.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 172.592 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.647 HG23 ' HD1' ' A' ' 69' ' ' PHE . 17.1 m -75.87 136.37 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.947 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.419 HG21 ' HG ' ' A' ' 33' ' ' LEU . 33.0 t -116.76 123.69 71.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.94 -171.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.608 ' HB3' HG23 ' A' ' 71' ' ' ILE . 10.5 tp -87.17 112.7 22.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.751 175.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.58 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.3 mm -87.36 105.08 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.57 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 18.1 t70 -109.65 134.88 51.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.761 0.315 . . . . 0.0 111.033 -175.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.516 ' HB3' HD13 ' A' ' 114' ' ' LEU . 61.7 m-85 -122.35 99.1 6.24 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.887 ' O ' ' HA ' ' A' ' 75' ' ' SER . 20.6 m -139.71 143.68 37.17 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.107 0.48 . . . . 0.0 111.5 -169.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.682 HG12 ' HB2' ' A' ' 47' ' ' ASN . 3.4 p -96.81 120.96 46.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 O-C-N 121.978 -0.451 . . . . 0.0 110.138 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.576 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 48.3 m-85 -77.22 79.38 3.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.749 0.785 . . . . 0.0 109.46 176.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -178.75 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.884 -1.507 . . . . 0.0 109.112 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.682 ' HB2' HG12 ' A' ' 44' ' ' VAL . 38.5 t-20 -65.41 140.43 58.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.627 -179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.89 -35.43 80.63 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.484 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -67.85 -19.89 65.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.065 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 m -68.03 -29.09 67.99 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.138 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.6 -55.58 16.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.832 0.349 . . . . 0.0 110.851 -178.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.07 86.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 0.0 110.711 178.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.614 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 72.1 t60 -61.58 -38.99 89.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.952 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.487 ' HA ' HD11 ' A' ' 57' ' ' LEU . 21.7 t-20 -68.73 -30.33 68.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.544 0.211 . . . . 0.0 110.712 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tt -69.74 -41.84 74.73 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.27 80.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.388 176.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 76.6 mt -67.98 -39.44 83.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.481 176.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.407 ' HE ' ' HB2' ' A' ' 58' ' ' ARG . 2.0 tpp180 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.13 -52.96 12.28 Favored 'General case' 0 CA--C 1.493 -1.237 0 CA-C-O 122.743 1.258 . . . . 0.0 108.08 -173.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.858 HD12 HD13 ' A' ' 140' ' ' ILE . 2.3 mm? -55.76 -31.7 62.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 112.219 -2.264 . . . . 0.0 110.888 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -75.25 -50.12 17.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.894 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -61.15 -22.03 64.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.529 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -81.67 -60.74 2.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.077 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -104.66 -7.69 19.43 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -166.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.531 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.88 165.8 16.88 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.491 -0.483 . . . . 0.0 111.169 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 56.9 m 70.89 -10.95 0.69 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.779 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.423 ' H ' ' C ' ' A' ' 65' ' ' ALA . 24.0 mt-30 -105.18 3.44 30.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.956 0.408 . . . . 0.0 110.729 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.539 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 114.3 45.73 0.66 Allowed Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.647 ' HD1' HG23 ' A' ' 37' ' ' VAL . 83.1 t80 -138.25 130.43 28.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.874 0.369 . . . . 0.0 110.822 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.43 ' HB3' ' HD3' ' A' ' 36' ' ' LYS . 22.4 tt0 -144.95 157.32 44.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.006 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.608 HG23 ' HB3' ' A' ' 39' ' ' LEU . 58.2 mt -127.45 136.43 60.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.305 -171.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.531 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 50.0 t80 -123.52 102.1 7.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.499 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.57 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.1 mt-30 -93.74 141.97 27.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 111.578 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.5 mt -122.26 122.17 65.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.038 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.887 ' HA ' ' O ' ' A' ' 43' ' ' THR . 78.7 p -99.73 142.01 31.78 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -175.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.733 HD13 HD12 ' A' ' 114' ' ' LEU . 81.5 mt -110.71 31.54 5.91 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.249 0.547 . . . . 0.0 109.565 172.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.532 ' HA ' HG23 ' A' ' 44' ' ' VAL . 5.3 p-10 -73.1 144.64 46.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.184 -173.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -108.31 16.7 34.97 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 164.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -125.69 94.6 4.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.151 -1.024 . . . . 0.0 109.278 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -72.89 -27.06 61.66 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.227 -175.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 -72.68 -32.85 66.12 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.766 -174.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -79.09 -40.53 30.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.534 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 39.9 t90 -61.11 -48.92 79.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.632 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.516 ' HG3' HD11 ' A' ' 23' ' ' LEU . 35.9 ttmt -62.46 -44.36 96.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.887 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 p -75.19 -34.25 61.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.359 . . . . 0.0 111.633 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.628 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 21.8 t -73.04 -44.99 60.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.466 ' HB3' ' SG ' ' A' ' 94' ' ' CYS . . . -67.55 -24.52 65.54 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.208 -178.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -63.39 -38.41 91.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.43 0.633 . . . . 0.0 109.709 176.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -93.99 11.41 29.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.969 -177.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 86' ' ' SER . 20.1 mt -97.64 133.68 23.29 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-O 121.535 0.683 . . . . 0.0 112.294 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.607 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 57.7 Cg_endo -80.45 -31.55 1.55 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 124.312 3.341 . . . . 0.0 113.071 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.607 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.8 p90 -100.77 -167.0 1.37 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.967 -173.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.531 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 54.1 t -81.68 132.72 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.782 -175.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -136.65 100.04 4.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.062 179.4 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.598 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 14.5 m -114.87 151.25 16.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.474 -175.336 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -107.88 137.44 45.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 0.0 111.882 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -92.14 135.43 33.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.036 174.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.77 -4.34 57.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -94.6 -14.78 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.721 -174.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 49.36 66.5 2.2 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.838 174.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.537 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 77.55 -5.17 2.18 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.414 0.685 . . . . 0.0 112.845 175.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -101.01 12.91 36.8 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.47 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.7 OUTLIER -61.96 126.59 27.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.89 -175.77 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.6 m -55.41 -28.88 56.96 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.372 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -61.3 -38.93 88.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.842 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.47 HG13 ' HB2' ' A' ' 103' ' ' SER . 71.9 mt -59.66 -35.06 57.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.839 -178.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.7 m -73.86 -27.6 61.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.929 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.84 -37.81 67.31 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.089 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.78 ' HB2' HG22 ' A' ' 111' ' ' VAL . 91.7 m-85 -77.34 -8.51 57.78 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 121.135 -0.226 . . . . 0.0 110.598 178.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.494 ' C ' HD21 ' A' ' 110' ' ' ASN . 0.2 OUTLIER 54.96 51.71 13.1 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -169.653 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.78 HG22 ' HB2' ' A' ' 109' ' ' TYR . 94.1 t -69.5 128.52 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.024 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.815 -179.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 16.8 p -73.17 -48.48 35.0 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.495 177.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -176.5 135.53 0.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.794 176.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.733 HD12 HD13 ' A' ' 76' ' ' LEU . 72.1 mt -89.1 166.36 22.21 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.064 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.6 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 14.2 Cg_exo -69.35 159.44 88.4 Favored 'Cis proline' 0 C--N 1.354 0.833 0 C-N-CA 124.597 -1.001 . . . . 0.0 113.802 1.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 67.9 m -153.07 174.41 14.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.739 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.9 p -142.15 155.71 19.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.58 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.3 m-85 -136.02 161.88 34.44 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.777 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.2 tp -111.76 133.48 53.96 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 4.2 t -131.29 128.41 61.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.854 0.359 . . . . 0.0 110.322 174.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . 0.53 ' HB3' HD22 ' A' ' 143' ' ' LEU . 10.1 p30 -90.79 174.6 7.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.245 178.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -54.17 -23.23 13.58 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -166.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.529 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 28.0 m-20 -83.82 9.86 10.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.649 0.261 . . . . 0.0 110.513 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.43 ' HB2' ' HD3' ' A' ' 34' ' ' LYS . 1.5 t-20 64.79 35.74 8.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.978 -174.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.529 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 43.9 mt-10 -109.48 138.04 46.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.025 -176.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.85 112.8 3.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.675 0.75 . . . . 0.0 110.85 176.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.777 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 45.7 m -78.01 -55.65 5.12 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.621 178.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.22 14.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.956 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.629 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 0.2 OUTLIER -99.31 159.37 15.05 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.218 178.649 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -55.69 -46.18 83.05 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 121.613 -0.327 . . . . 0.0 113.64 -175.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.629 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.0 OUTLIER -71.78 -29.66 64.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.261 0.553 . . . . 0.0 110.018 179.765 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.451 ' N ' HD21 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -68.33 -39.53 81.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.613 177.318 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.821 HG23 ' HG ' ' A' ' 136' ' ' LEU . 75.3 mt -70.71 147.36 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.535 178.33 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.435 ' HE3' ' HB3' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -140.71 108.5 5.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 171.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.475 ' OD1' ' HB3' ' A' ' 137' ' ' ASP . 15.7 t70 67.7 102.31 0.05 OUTLIER 'General case' 0 C--O 1.233 0.202 0 O-C-N 124.432 1.083 . . . . 0.0 109.867 -168.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.821 ' HG ' HG23 ' A' ' 133' ' ' ILE . 3.8 mp -75.13 -22.24 58.31 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.69 -177.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.475 ' HB3' ' OD1' ' A' ' 135' ' ' ASP . 9.7 t70 -52.73 -53.87 41.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.18 175.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.636 ' HB3' ' HE2' ' A' ' 142' ' ' LYS . 33.1 mm-40 -56.98 -50.4 72.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.331 173.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.522 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -53.89 -54.27 41.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.174 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.858 HD13 HD12 ' A' ' 60' ' ' LEU . 31.0 mt -67.11 -33.54 63.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.043 0.449 . . . . 0.0 110.928 -177.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -65.21 -32.78 74.63 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.402 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.636 ' HE2' ' HB3' ' A' ' 138' ' ' GLU . 54.1 mttm -80.46 -20.45 43.73 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.95 177.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.53 HD22 ' HB3' ' A' ' 121' ' ' ASN . 65.5 mt -73.6 -43.05 60.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.901 177.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 91.9 mt -63.77 -42.48 97.78 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.575 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -76.35 -15.0 60.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.411 177.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.69 61.2 3.66 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.045 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . 0.548 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 18.6 p-80 -68.47 96.78 0.71 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.422 0.63 . . . . 0.0 110.212 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -64.73 -34.27 77.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.372 -174.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -165.26 19.4 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.338 0.59 . . . . 0.0 110.644 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.548 ' O ' ' HB2' ' A' ' 147' ' ' HIS . 97.3 m-70 -135.1 -159.82 0.99 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 28.7 m80 -104.81 -174.54 2.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 169.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.202 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ptm . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -100.1 157.97 16.18 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 123.392 0.432 . . . . 0.0 110.356 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.418 ' HG ' HG12 ' A' ' 5' ' ' ILE . 41.5 tp -178.01 -29.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -178.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 56.66 50.94 11.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.257 173.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.418 HG12 ' HG ' ' A' ' 3' ' ' LEU . 47.1 mm -108.18 87.59 4.08 Favored Pre-proline 0 C--N 1.32 -0.691 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 169.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.53 165.03 6.47 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.044 2.496 . . . . 0.0 113.009 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.561 ' C ' ' H ' ' A' ' 9' ' ' LYS . 1.1 pt-20 -137.05 25.83 2.99 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.441 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -69.48 25.43 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.079 -175.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.57 ' HA ' ' CG ' ' A' ' 12' ' ' GLU . 27.5 mmtm 65.66 -156.34 0.27 Allowed 'General case' 0 C--O 1.234 0.276 0 C-N-CA 123.417 0.687 . . . . 0.0 110.7 175.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.9 mt 71.7 -71.23 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-O 121.415 0.626 . . . . 0.0 109.758 -171.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 11' ' ' LYS . 23.9 mmtp -136.46 0.14 2.48 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.048 172.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.57 ' CG ' ' HA ' ' A' ' 9' ' ' LYS . 47.4 mt-10 50.16 31.91 5.49 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.621 177.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -162.42 29.0 0.11 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.777 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.7 m -154.35 156.02 36.14 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.448 ' CD1' HG13 ' A' ' 120' ' ' VAL . 10.3 tt -52.77 152.7 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.913 175.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.649 ' H ' HD12 ' A' ' 16' ' ' ILE . 3.9 mp -74.75 103.79 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 173.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.79 108.17 9.63 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.454 HD11 ' HH ' ' A' ' 109' ' ' TYR . 9.1 mt -100.76 116.92 45.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.119 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.536 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 78.7 mt-30 -107.85 101.48 10.76 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.192 0.52 . . . . 0.0 110.82 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.835 ' HB2' HG12 ' A' ' 95' ' ' VAL . 29.6 mt -138.87 162.1 35.65 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.51 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 51.8 mttm -94.25 150.06 20.65 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.344 0.592 . . . . 0.0 111.435 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.555 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -81.24 -170.26 2.66 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.558 177.213 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.658 HD11 ' HE2' ' A' ' 84' ' ' LYS . 44.7 tp -54.82 -39.69 68.78 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.723 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.458 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 52.8 mttp -78.04 -26.95 48.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.445 -176.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 114.54 11.49 11.61 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.114 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.458 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 36.4 m-80 -82.79 110.45 17.83 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.51 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.3 m -68.27 113.55 5.98 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.486 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.6 mmm180 -103.42 139.58 38.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.037 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.536 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 82.4 p -120.48 160.3 23.42 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.576 HD11 ' O ' ' A' ' 16' ' ' ILE . 63.4 mt -80.55 -25.29 38.7 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.745 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.7 p -66.49 -20.17 65.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 173.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -79.28 -40.86 29.44 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 122.232 1.015 . . . . 0.0 108.476 175.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 tp -78.29 6.26 8.64 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.824 -1.534 . . . . 0.0 110.879 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.686 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.5 ttmm -73.96 114.96 12.85 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.344 -177.03 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.61 -25.41 2.29 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -173.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.618 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -117.77 168.24 10.64 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.438 175.75 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.747 HG22 ' HD1' ' A' ' 69' ' ' PHE . 29.4 m -82.92 124.58 39.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 173.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.671 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 72.3 t -113.05 136.92 47.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.565 0.698 . . . . 0.0 112.101 -168.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 39' ' ' LEU . 9.4 tp -98.99 119.18 37.33 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.624 177.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -97.12 104.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -107.68 135.0 49.84 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.626 ' O ' ' HA ' ' A' ' 115' ' ' PRO . 82.9 m-85 -119.04 101.62 8.16 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.1 t -128.63 -178.21 4.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.186 -172.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.554 HG11 ' HB3' ' A' ' 47' ' ' ASN . 0.4 OUTLIER -135.79 117.6 20.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.265 177.456 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.494 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 32.0 m-85 -78.64 80.07 5.03 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.546 0.689 . . . . 0.0 110.689 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -179.67 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.757 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.554 ' HB3' HG11 ' A' ' 44' ' ' VAL . 4.6 t30 -77.51 132.71 38.51 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.562 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.05 -26.68 68.36 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.475 -173.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.91 -32.5 72.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.304 0.573 . . . . 0.0 109.603 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.3 m -68.22 -27.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.733 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.1 43.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.743 0.306 . . . . 0.0 111.042 -177.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.87 -34.09 76.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.48 . . . . 0.0 110.796 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.442 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 76.5 t60 -64.31 -38.75 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.554 ' HA ' HD12 ' A' ' 57' ' ' LEU . 6.2 m-20 -70.89 -18.83 62.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.615 -179.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tt -77.18 -41.75 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.76 82.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.373 0.606 . . . . 0.0 109.814 175.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 54' ' ' ASN . 82.3 mt -65.36 -38.6 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.684 176.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.406 ' HA ' ' CZ3' ' A' ' 92' ' ' TRP . 5.9 tpp180 -61.89 -30.34 70.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.001 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -77.42 -51.61 10.5 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -174.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.846 HD12 HD13 ' A' ' 140' ' ' ILE . 1.8 mm? -56.14 -29.79 61.24 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.675 -2.057 . . . . 0.0 111.625 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -78.71 -46.34 19.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.085 -177.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.35 -22.48 66.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.545 0.688 . . . . 0.0 110.68 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -82.86 -61.06 1.97 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.129 -0.941 . . . . 0.0 112.329 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.519 ' HB3' HD13 ' A' ' 144' ' ' LEU . 92.9 m-85 -112.24 -5.64 14.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -162.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.556 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.04 -36.94 75.87 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 m -70.22 -5.74 29.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.522 ' HB2' HD12 ' A' ' 144' ' ' LEU . 45.3 mt-30 -110.64 12.91 22.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.007 0.432 . . . . 0.0 111.292 -178.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.463 ' O ' HG21 ' A' ' 37' ' ' VAL . . . 100.98 52.35 1.1 Allowed Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.786 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.747 ' HD1' HG22 ' A' ' 37' ' ' VAL . 43.3 t80 -131.12 134.34 46.47 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.618 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 10.6 tp10 -137.74 144.61 41.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.516 -177.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.417 HD11 ' CE3' ' A' ' 92' ' ' TRP . 60.3 mt -109.29 125.65 66.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.184 0.516 . . . . 0.0 110.426 177.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.486 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 85.6 t80 -111.0 102.02 10.53 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.54 -0.755 . . . . 0.0 108.974 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -95.31 134.45 38.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.252 -174.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.552 HD11 ' CE2' ' A' ' 42' ' ' PHE . 43.2 mt -120.11 112.16 35.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 0.0 110.059 174.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.427 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 30.1 t -91.11 140.66 29.61 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.7 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.621 HD13 HD12 ' A' ' 114' ' ' LEU . 16.6 mt -93.48 13.62 21.21 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.468 ' CG ' ' H ' ' A' ' 78' ' ' GLY . 5.2 p-10 44.13 -111.33 0.21 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.366 -1.288 . . . . 0.0 113.393 178.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.468 ' H ' ' CG ' ' A' ' 77' ' ' ASP . . . 92.75 -29.13 8.21 Favored Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 -170.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.73 119.51 11.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -72.58 -30.27 64.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.55 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -67.48 -57.07 7.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.391 -174.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -66.02 -38.31 88.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.397 -174.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.51 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 36.1 t90 -62.42 -48.11 81.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.658 ' HE2' HD11 ' A' ' 23' ' ' LEU . 3.2 ttmt -58.11 -54.89 41.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.488 -174.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -66.03 -33.74 76.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.916 -0.583 . . . . 0.0 112.194 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.52 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.2 t -83.38 -32.8 25.99 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.458 -177.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.451 ' CB ' ' HG ' ' A' ' 94' ' ' CYS . . . -75.82 -35.0 60.15 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.501 ' HB2' ' CD2' ' A' ' 23' ' ' LEU . 19.0 t70 -70.34 -28.46 65.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.035 -176.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -94.08 16.43 14.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.482 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.57 HD11 ' HB2' ' A' ' 94' ' ' CYS . 16.5 mt -88.71 148.32 41.42 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.36 0.6 . . . . 0.0 112.166 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.663 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.6 Cg_endo -76.04 -37.71 1.45 Allowed 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.693 2.929 . . . . 0.0 113.03 177.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.663 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 10.9 p90 -104.58 -167.91 1.41 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.778 -175.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.424 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 38.4 t -82.4 125.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.608 -175.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.57 ' HB2' HD11 ' A' ' 90' ' ' LEU . 30.8 t -121.91 108.78 13.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.241 0.543 . . . . 0.0 109.977 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.835 HG12 ' HB2' ' A' ' 20' ' ' LEU . 14.1 t -114.58 162.01 12.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.288 -172.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.416 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . 44.0 ttp180 -128.44 137.24 51.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 111.277 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -87.94 145.97 25.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.57 -24.64 45.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.089 0.471 . . . . 0.0 111.357 -176.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.54 32.18 5.7 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.917 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . -57.76 82.62 0.01 OUTLIER Glycine 0 C--N 1.342 0.876 0 O-C-N 123.757 0.66 . . . . 0.0 114.129 -173.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 167.24 -33.9 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.544 1.138 . . . . 0.0 108.561 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.92 12.07 5.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.97 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.543 ' HB3' HG13 ' A' ' 106' ' ' ILE . 41.9 t -62.99 135.85 57.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.604 -177.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.549 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.3 m -54.99 -37.24 66.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.13 -176.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -56.84 -56.48 21.07 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.301 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.638 HG23 HG11 ' A' ' 111' ' ' VAL . 11.5 mt -58.61 -33.74 49.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.664 -175.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 18.6 m -71.01 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.427 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 104' ' ' SER . 94.6 mt -64.55 -34.96 79.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.751 0.31 . . . . 0.0 110.977 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.454 ' HH ' HD11 ' A' ' 18' ' ' ILE . 49.9 m-85 -77.69 -4.11 44.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.895 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 t30 56.46 65.88 1.32 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.883 0.849 . . . . 0.0 109.728 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.638 HG11 HG23 ' A' ' 106' ' ' ILE . 2.7 p -73.41 122.95 27.38 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.437 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.8 m -126.35 0.23 7.0 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.458 0.647 . . . . 0.0 109.64 173.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -169.5 119.72 0.67 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.471 -178.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.621 HD12 HD13 ' A' ' 76' ' ' LEU . 36.2 mt -124.76 157.69 65.13 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 171.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.626 ' HA ' ' O ' ' A' ' 42' ' ' PHE . 43.6 Cg_endo -68.25 150.16 85.55 Favored 'Cis proline' 0 C--N 1.347 0.462 0 C-N-CA 123.84 -1.317 . . . . 0.0 114.234 1.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.1 m -136.44 164.35 28.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.207 174.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 p -133.7 152.45 34.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.048 0.452 . . . . 0.0 110.68 -176.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.456 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 71.5 m-85 -133.77 152.1 51.78 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.356 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.615 HD11 HD13 ' A' ' 136' ' ' LEU . 35.4 tp -111.85 142.98 43.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.123 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.671 ' CG2' ' HB ' ' A' ' 38' ' ' VAL . 4.6 m -136.56 146.3 28.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 169.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -83.38 171.91 13.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 8.9 ptp180 -65.16 -11.81 44.38 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -168.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -80.55 6.48 12.38 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 172.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.686 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 2.2 t-20 56.21 53.88 8.43 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.988 -173.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.442 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 75.1 mm-40 -129.98 143.95 51.07 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.625 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.636 ' HA ' HG11 ' A' ' 120' ' ' VAL . 2.6 tt -57.07 119.33 6.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.284 0.564 . . . . 0.0 110.954 -172.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.86 -51.84 5.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.161 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.51 171.56 7.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -176.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.577 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -99.09 163.83 12.41 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.638 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.407 ' HA2' HD11 ' A' ' 133' ' ' ILE . . . -44.42 -42.52 7.2 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 -175.134 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -41.42 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 117.27 0.535 . . . . 0.0 110.948 -177.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -63.48 -27.97 69.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.167 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.792 HG22 HD22 ' A' ' 136' ' ' LEU . 90.0 mt -68.24 -33.28 59.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.604 178.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.629 ' HB2' ' HZ1' ' A' ' 134' ' ' LYS . 5.1 mtmp? 72.09 -55.3 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.444 0.698 . . . . 0.0 110.263 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -154.47 124.68 6.84 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.508 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.792 HD22 HG22 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -66.98 -42.98 84.16 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.678 -173.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.535 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.0 t70 -52.14 -51.28 58.92 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.107 0.479 . . . . 0.0 109.961 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.28 -50.54 50.09 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.4 175.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -71.6 -46.81 58.14 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -173.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ILE . . . . . 0.846 HD13 HD12 ' A' ' 60' ' ' LEU . 36.4 mt -59.04 -36.52 62.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 0.0 110.379 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -59.35 -49.47 77.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.451 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -75.51 -21.53 57.92 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.711 -178.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' LEU . . . . . 0.542 HD11 HD21 ' A' ' 119' ' ' LEU . 86.2 mt -69.59 -40.36 76.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.333 0.587 . . . . 0.0 110.436 175.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.522 HD12 ' HB2' ' A' ' 67' ' ' GLN . 73.2 mt -81.96 -55.74 4.4 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.253 179.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 145' ' ' GLU . 6.4 mm-40 -77.13 1.63 17.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.042 -175.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.404 ' C ' ' H ' ' A' ' 148' ' ' HIS . . . -65.67 -45.45 89.11 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.199 172.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' HIS . . . . . 0.424 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 96.9 m-70 62.15 -0.45 0.48 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 173.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' HIS . . . . . 0.404 ' H ' ' C ' ' A' ' 146' ' ' GLY . 43.1 t-80 69.27 -74.73 0.08 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.483 0.713 . . . . 0.0 112.642 171.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -104.96 4.32 31.66 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.28 0.562 . . . . 0.0 110.81 -174.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' HIS . . . . . 0.424 ' O ' ' HB2' ' A' ' 147' ' ' HIS . 18.2 m-70 -145.15 176.54 9.45 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 173.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -135.11 177.01 8.14 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 118.138 0.426 . . . . 0.0 110.413 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 . . . . . 0 C--O 1.244 0.781 0 CA-C-O 118.407 -0.806 . . . . 0.0 109.214 175.002 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 121.166 0.508 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.52 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.9 mp -95.95 122.81 47.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.555 175.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.406 ' OD1' ' HB2' ' A' ' 29' ' ' SER . 26.2 t70 -87.08 106.17 17.68 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.69 ' O ' ' HA ' ' A' ' 29' ' ' SER . 13.0 mt -89.4 110.2 21.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.457 -173.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.523 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 34.3 mt-30 -105.59 100.03 9.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.196 0.522 . . . . 0.0 110.776 -178.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 97' ' ' ASP . 32.7 mt -140.22 151.01 44.84 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 174.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.684 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.9 mttm -90.89 155.34 18.82 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.037 -173.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 15.2 p30 -91.76 -172.6 3.26 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.03 -175.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.742 HD11 ' HA ' ' A' ' 84' ' ' LYS . 21.2 tp -57.31 -27.38 62.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.319 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.419 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 68.0 mttm -96.05 -12.5 24.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.062 0.458 . . . . 0.0 111.026 -175.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.91 -3.34 31.86 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.38 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.553 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 11.4 m120 -72.26 118.76 15.55 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.6 m -73.08 106.21 4.85 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.209 -177.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.438 ' HA ' ' HD3' ' A' ' 28' ' ' ARG . 16.5 mmt180 -87.81 142.14 28.05 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.742 -177.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.69 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 31.9 p -135.33 159.76 40.55 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.591 HD22 HG11 ' A' ' 38' ' ' VAL . 47.0 mt -72.72 -21.35 61.05 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.446 0.641 . . . . 0.0 110.004 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.411 ' HA ' ' NZ ' ' A' ' 34' ' ' LYS . 3.6 p -73.17 -15.5 61.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.144 172.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.437 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t70 -87.37 -40.12 14.7 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.751 0.786 . . . . 0.0 109.467 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.683 HD23 HG13 ' A' ' 38' ' ' VAL . 7.8 tp -86.6 15.81 5.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.281 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.6 ' HB2' ' HZ2' ' A' ' 34' ' ' LYS . 4.4 ttmp? -66.76 -11.17 53.76 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.332 0.587 . . . . 0.0 111.517 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.21 -20.58 71.32 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.625 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.669 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 76.7 mttt -129.95 178.8 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.791 HG23 ' HD1' ' A' ' 69' ' ' PHE . 19.6 m -81.02 129.0 38.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 166.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.683 HG13 HD23 ' A' ' 33' ' ' LEU . 24.1 t -101.68 121.62 52.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.123 0.487 . . . . 0.0 111.868 -168.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.407 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 14.5 tp -88.41 116.18 26.46 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.366 173.086 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.557 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 10.0 mm -90.08 105.25 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.497 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 10.3 t70 -106.99 130.3 54.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.922 0.391 . . . . 0.0 110.902 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.699 ' HB3' HD11 ' A' ' 76' ' ' LEU . 66.5 m-85 -121.3 100.74 7.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.839 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 t -146.64 176.39 9.87 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.625 -178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.507 ' HB ' ' HB3' ' A' ' 77' ' ' ASP . 5.2 m -111.06 119.49 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.135 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.728 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 43.8 m-85 -74.42 83.52 1.96 Allowed 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 173.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 177.45 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.933 0.873 . . . . 0.0 109.791 -168.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.448 ' HB2' HG23 ' A' ' 44' ' ' VAL . 9.0 t-20 -95.04 142.52 27.42 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.06 -1.427 . . . . 0.0 110.837 -167.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -29.53 66.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.437 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.9 ptp -65.98 -22.08 66.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.011 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 t -73.33 -29.73 62.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.54 -52.17 62.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.119 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.26 -37.0 80.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.746 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.471 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 78.6 t60 -64.84 -36.79 85.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.394 178.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.558 ' HA ' HD12 ' A' ' 57' ' ' LEU . 21.5 t-20 -67.17 -32.14 73.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.751 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tt -65.45 -42.74 92.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.972 0.415 . . . . 0.0 109.925 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.87 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.298 0.57 . . . . 0.0 110.368 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.558 HD12 ' HA ' ' A' ' 54' ' ' ASN . 62.7 mt -69.03 -40.46 78.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.757 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 58' ' ' ARG . 9.3 tpt180 -60.48 -30.12 69.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.192 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -76.4 -52.03 10.69 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.849 HD12 HD12 ' A' ' 140' ' ' ILE . 2.2 mm? -57.43 -27.84 62.76 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 112.681 -2.054 . . . . 0.0 111.415 178.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -76.29 -46.57 27.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.007 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.4 -22.18 65.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.247 0.546 . . . . 0.0 110.547 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.543 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 37.3 mttm -77.39 -61.16 2.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.035 -179.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 141' ' ' LYS . 95.8 m-85 -115.17 -8.05 12.4 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -164.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.565 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.89 -36.05 76.14 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.176 0.444 . . . . 0.0 111.491 -176.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.0 m -64.43 -19.99 65.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.646 -178.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -102.98 2.39 34.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.678 0.275 . . . . 0.0 111.267 -176.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 112.54 55.58 0.46 Allowed Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.567 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.791 ' HD1' HG23 ' A' ' 37' ' ' VAL . 31.4 t80 -131.54 143.33 50.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.669 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.75 148.24 38.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.976 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.536 HD13 ' HB3' ' A' ' 57' ' ' LEU . 56.9 mt -107.69 117.86 54.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.144 0.497 . . . . 0.0 110.066 176.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -99.32 99.32 10.25 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 43.9 tt0 -102.45 123.77 46.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.14 -172.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 49.6 mt -105.69 125.24 61.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.612 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.728 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 4.0 p -84.95 121.91 28.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.786 176.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.699 HD11 ' HB3' ' A' ' 42' ' ' PHE . 16.8 mt -106.52 5.74 29.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.284 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.509 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.1 p-10 -68.81 -60.93 2.04 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.162 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.55 32.73 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.478 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 33.8 t70 -113.16 104.18 12.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.375 0.607 . . . . 0.0 110.728 -178.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 31.0 mt-10 -68.78 -14.35 62.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.934 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' HIS . . . . . 0.478 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 61.0 m80 -66.49 -59.35 3.73 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.624 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -74.43 -34.46 63.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.276 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -60.8 -53.38 58.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.955 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.742 ' HA ' HD11 ' A' ' 23' ' ' LEU . 19.3 ttmt -63.87 -41.62 97.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.689 0.281 . . . . 0.0 111.391 -173.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -69.75 -41.46 75.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.84 0.353 . . . . 0.0 111.548 -177.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -75.54 -47.56 26.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.369 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.655 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -67.79 -27.16 66.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.833 -174.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -58.54 -27.26 64.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.25 0.548 . . . . 0.0 111.429 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -108.67 13.0 25.44 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.773 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.7 mt -90.37 144.69 31.27 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 111.718 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.627 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 60.5 Cg_endo -70.25 -52.81 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.688 2.925 . . . . 0.0 113.518 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.627 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.8 p90 -87.41 -169.02 2.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.144 -171.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.8 t -80.96 126.83 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.849 -173.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.655 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 2.0 p -123.73 108.65 12.76 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.508 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 19.7 m -121.43 172.17 8.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.233 -178.753 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -125.57 144.36 50.6 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.984 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.49 ' HA ' HD13 ' A' ' 20' ' ' LEU . 19.8 t70 -81.6 168.74 17.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.903 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.28 -38.33 27.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.252 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.424 ' CG ' ' HB2' ' A' ' 102' ' ' TYR . 7.3 t-20 -122.97 -11.77 8.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.008 0.432 . . . . 0.0 111.339 -175.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.552 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 78.64 -108.91 2.74 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.472 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.01 -23.94 64.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.079 0.466 . . . . 0.0 110.858 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.424 ' HB2' ' CG ' ' A' ' 99' ' ' ASN . 55.6 m-85 -99.08 29.16 4.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.804 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.488 ' HB3' HG13 ' A' ' 106' ' ' ILE . 37.1 t -60.15 140.0 57.19 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.507 -178.1 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.562 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.5 m -63.36 -31.26 72.37 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.745 174.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -67.19 -48.82 66.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.995 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.591 HD11 HD13 ' A' ' 76' ' ' LEU . 58.9 mt -53.71 -38.03 33.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.623 175.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 20.4 m -68.61 -39.56 80.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.742 177.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.8 mt -68.59 -38.72 80.9 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.62 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.536 ' OH ' HD11 ' A' ' 18' ' ' ILE . 89.1 m-85 -69.8 -30.56 68.13 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.818 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 . . . . . 0 N--CA 1.461 0.121 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -165.812 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.462 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 3.6 mm? . . . . . 0 CA--C 1.537 0.478 0 CA-C-O 121.059 0.457 . . . . 0.0 111.708 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.462 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 52.7 Cg_endo -70.56 162.09 87.1 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.239 -1.567 . . . . 0.0 111.716 -0.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.6 t -147.89 176.66 9.97 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.221 0.534 . . . . 0.0 110.748 -176.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.509 HG12 ' HA3' ' A' ' 130' ' ' GLY . 2.8 p -142.82 154.7 17.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 175.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.557 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.3 m-85 -143.3 158.17 43.86 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.965 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.5 tp -112.33 143.87 42.7 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.64 -173.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.494 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 2.8 t -140.95 131.69 27.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.035 172.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.584 ' HB3' HD22 ' A' ' 143' ' ' LEU . 3.9 p-10 -96.62 176.98 5.81 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.366 176.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.456 ' N ' HG12 ' A' ' 37' ' ' VAL . 84.0 mtt-85 -43.33 -42.56 4.59 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -166.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.561 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 75.3 m-20 -78.95 12.73 2.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 121.995 -0.441 . . . . 0.0 110.457 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 122' ' ' ARG . 61.7 t30 61.18 44.12 10.32 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.487 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.561 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 87.4 mt-10 -96.23 133.13 40.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.288 177.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.7 tt -72.34 107.94 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.965 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 63.8 m -71.66 -55.49 7.62 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.291 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 178.95 173.04 0.77 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.037 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.579 ' HD3' ' OE2' ' A' ' 131' ' ' GLU . 76.4 mtt180 -83.3 159.28 21.93 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.745 176.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.509 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -62.81 -34.33 89.47 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 111.747 -0.541 . . . . 0.0 111.747 175.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.579 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 2.0 mp0 -64.19 -25.39 68.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.248 0.547 . . . . 0.0 110.356 177.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -90.69 -26.86 19.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.315 0.579 . . . . 0.0 110.194 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.588 ' CD1' ' HB2' ' A' ' 119' ' ' LEU . 23.4 mt -99.11 94.79 3.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.147 -175.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.17 11.71 24.67 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.227 173.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -143.43 41.4 1.47 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.283 -170.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.577 ' HA ' ' HB3' ' A' ' 139' ' ' ALA . 3.7 mp -53.66 -35.37 60.95 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -176.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.582 ' HA ' HD11 ' A' ' 60' ' ' LEU . 24.0 t70 -54.53 -58.41 7.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.738 0.304 . . . . 0.0 110.551 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 4.4 mm-40 -65.68 -32.61 74.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 111.916 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.716 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.68 -56.01 24.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.618 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.849 HD12 HD12 ' A' ' 60' ' ' LEU . 48.2 mt -61.47 -34.98 63.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.143 0.497 . . . . 0.0 110.108 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 64' ' ' TYR . 25.6 tttm -60.0 -53.41 58.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.896 176.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 138' ' ' GLU . 13.8 pttm -67.27 -27.34 67.12 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 48.3 mt -64.22 -42.12 96.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.669 0.747 . . . . 0.0 110.027 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.423 HD22 ' NH2' ' A' ' 122' ' ' ARG . 88.0 mt . . . . . 0 C--N 1.322 -0.615 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.987 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.516 HG21 ' O ' ' A' ' 124' ' ' ASN . 9.4 pt . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.553 ' O ' HD12 ' A' ' 30' ' ' LEU . 79.5 mt -121.66 103.52 13.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 174.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -104.23 130.81 52.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.527 HG22 ' HG ' ' A' ' 20' ' ' LEU . 14.6 mt -116.76 121.47 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.228 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.558 ' HG3' ' HB3' ' A' ' 29' ' ' SER . 1.7 mp0 -98.08 101.75 13.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.732 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.527 ' HG ' HG22 ' A' ' 18' ' ' ILE . 33.7 mt -132.03 155.6 47.74 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 50.7 mttm -86.94 151.07 23.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.934 0.397 . . . . 0.0 110.793 178.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.643 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -85.39 -177.53 6.49 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.404 175.075 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.876 HD21 ' HB3' ' A' ' 87' ' ' ALA . 1.0 OUTLIER -53.89 -36.73 63.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.546 0.689 . . . . 0.0 112.005 179.346 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HB2' HD22 ' A' ' 26' ' ' ASN . 39.5 mttp -78.22 -18.91 54.8 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.718 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 107.69 9.28 28.97 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.474 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.466 HD22 ' HB2' ' A' ' 24' ' ' LYS . 42.5 m-80 -81.57 108.86 15.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.479 0.18 . . . . 0.0 110.899 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.625 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 62.6 m -68.32 110.22 3.98 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.482 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 5.8 mmm180 -104.38 130.71 52.23 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.991 0.424 . . . . 0.0 110.329 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.558 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 45.7 p -104.31 159.04 16.04 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 169.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 16' ' ' ILE . 50.7 mt -69.6 -26.0 64.24 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.487 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.4 p -68.55 -16.29 63.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.73 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.502 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -78.55 -24.83 45.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 122.295 1.045 . . . . 0.0 108.913 176.788 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.606 HD23 HG13 ' A' ' 38' ' ' VAL . 1.5 tp -99.18 6.08 46.54 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.133 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.515 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 51.0 tttm -69.77 144.53 52.67 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -176.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.73 -21.46 43.79 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 1.104 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 10.0 ttmt -124.07 155.8 37.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.425 -0.887 . . . . 0.0 108.859 178.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.793 HG23 ' HD1' ' A' ' 69' ' ' PHE . 26.9 m -81.59 140.3 16.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -176.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.606 HG13 HD23 ' A' ' 33' ' ' LEU . 32.2 t -122.56 129.02 75.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.27 0.557 . . . . 0.0 111.9 -169.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.603 HD22 HG23 ' A' ' 71' ' ' ILE . 7.0 tt -91.65 112.62 24.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.035 172.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.586 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 15.7 mm -91.03 105.75 16.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.235 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -109.67 139.77 44.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.987 0.423 . . . . 0.0 111.244 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.5 102.43 7.38 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.467 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.9 t -139.63 164.33 30.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.989 0.423 . . . . 0.0 111.62 -174.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.646 HG12 ' HA ' ' A' ' 77' ' ' ASP . 3.3 m -106.47 126.68 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.243 176.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.558 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 21.5 m-85 -87.8 83.42 7.13 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 -177.49 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.527 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 0.3 OUTLIER 177.14 -50.03 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 114.666 -1.152 . . . . 0.0 108.585 -177.296 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.595 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.1 t30 -70.26 133.13 46.71 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.285 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.88 -24.63 38.29 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.557 -173.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.6 mtt -59.76 -26.69 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.851 177.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -75.8 -40.97 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.432 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.47 -59.25 5.26 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.771 -175.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.89 71.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.707 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.496 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 t60 -65.19 -45.37 85.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.793 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.512 ' HA ' HD12 ' A' ' 57' ' ' LEU . 89.5 m-20 -69.07 -25.21 64.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.154 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.6 tt -73.09 -44.9 59.79 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.52 -35.34 74.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.36 0.6 . . . . 0.0 110.03 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -67.07 -37.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.867 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.424 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 10.1 tpp180 -60.95 -28.31 68.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.497 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -77.99 -53.75 7.07 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 122.666 1.222 . . . . 0.0 107.879 -177.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.757 HD12 HD12 ' A' ' 140' ' ' ILE . 2.4 mm? -55.36 -29.1 57.74 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 112.282 -2.235 . . . . 0.0 111.506 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -75.54 -48.29 23.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.912 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -61.71 -21.89 64.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.251 0.548 . . . . 0.0 110.431 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -80.35 -57.57 3.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.319 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -108.17 -5.59 16.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -167.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.514 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -70.63 178.69 2.9 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.867 178.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.5 m 71.61 -35.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.326 0.65 . . . . 0.0 111.602 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.42 ' H ' ' C ' ' A' ' 65' ' ' ALA . 50.6 mt-30 -79.45 -0.49 33.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 111.114 178.006 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.589 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 110.71 47.53 0.78 Allowed Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.907 -0.664 . . . . 0.0 111.896 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.793 ' HD1' HG23 ' A' ' 37' ' ' VAL . 65.4 t80 -129.57 141.2 51.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.55 0.214 . . . . 0.0 110.872 -179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 1.104 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.1 tp10 -137.38 153.32 50.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.14 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.603 HG23 HD22 ' A' ' 39' ' ' LEU . 47.8 mt -111.9 124.77 68.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 173.026 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.1 t80 -109.69 100.92 9.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.204 0.526 . . . . 0.0 109.884 -177.102 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 94' ' ' CYS . 15.9 mm100 -83.33 125.97 32.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.263 -178.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.8 mt -111.71 111.1 34.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 43' ' ' THR . 53.5 p -92.62 115.03 27.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.98 0.419 . . . . 0.0 110.815 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.622 HD11 HD22 ' A' ' 114' ' ' LEU . 0.5 OUTLIER -109.21 29.05 7.88 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.099 0.476 . . . . 0.0 110.106 177.507 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.646 ' HA ' HG12 ' A' ' 44' ' ' VAL . 16.8 t70 -73.41 -77.67 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.572 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.17 -31.13 2.38 Favored Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.872 -178.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -81.61 135.97 35.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.165 0.507 . . . . 0.0 111.763 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -79.34 -52.14 8.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.963 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -66.71 -29.7 69.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -165.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PHE . . . . . 0.402 ' CD2' ' HA ' ' A' ' 46' ' ' ASN . 17.6 t80 -88.63 -40.05 13.61 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.48 ' CZ2' ' HG ' ' A' ' 23' ' ' LEU . 28.5 t90 -57.51 -47.62 81.46 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.326 172.433 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.664 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 14.2 mtpp -65.66 -47.71 74.61 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -176.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.5 p -63.92 -38.52 91.38 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.318 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.445 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 16.8 m -78.71 -42.72 27.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.135 -177.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.876 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -88.53 -33.46 17.74 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -169.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 2.0 t0 -73.43 -12.19 60.72 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 110.017 -174.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -101.99 13.49 34.61 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.011 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 87' ' ' ALA . 53.6 mt -96.69 150.33 36.84 Favored Pre-proline 0 N--CA 1.447 -0.592 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.525 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.736 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.2 Cg_endo -74.02 -42.39 0.77 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.991 3.127 . . . . 0.0 113.125 -177.115 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.736 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.7 p90 -90.15 -167.43 1.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.37 -171.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.401 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 49.0 t -81.69 130.79 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.158 -174.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.727 ' HA ' ' HB2' ' A' ' 73' ' ' GLN . 53.1 m -133.52 102.13 5.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.889 0.376 . . . . 0.0 110.233 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.643 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.0 m -114.15 173.25 3.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.761 -175.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -124.34 136.19 53.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.785 0.326 . . . . 0.0 111.611 -177.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -72.35 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.396 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.32 -25.46 33.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.1 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -97.75 -12.33 22.39 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.861 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 61.78 66.07 2.85 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.616 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.53 ' HB2' HD12 ' A' ' 76' ' ' LEU . . . 77.81 -16.11 0.69 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.397 0.679 . . . . 0.0 111.749 177.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -92.05 19.47 6.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.208 0.528 . . . . 0.0 109.712 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.509 ' HB3' HG13 ' A' ' 106' ' ' ILE . 9.2 t -72.81 129.76 38.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.123 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 3.8 p -62.09 -30.88 71.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.458 -177.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.481 ' HA ' HD12 ' A' ' 108' ' ' LEU . 55.6 m-85 -61.55 -34.54 75.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.518 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.509 HG13 ' HB3' ' A' ' 103' ' ' SER . 65.6 mt -58.92 -39.28 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.0 0.429 . . . . 0.0 110.478 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.3 m -74.36 -29.06 61.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 177.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.481 HD12 ' HA ' ' A' ' 105' ' ' TYR . 94.9 mt -70.57 -25.35 63.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.209 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.457 ' HB3' ' CE2' ' A' ' 118' ' ' PHE . 68.4 m-85 -77.54 -12.81 60.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.23 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 . . . . . 0 N--CA 1.462 0.15 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -171.749 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.696 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 2.4 tt . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.696 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 44.3 Cg_exo -51.22 144.04 8.78 Favored 'Cis proline' 0 C--N 1.362 1.261 0 CA-C-N 120.022 1.043 . . . . 0.0 114.079 2.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.9 t -139.05 175.33 9.65 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.799 -173.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.653 HG11 HD11 ' A' ' 136' ' ' LEU . 9.3 p -142.32 152.54 18.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.822 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.63 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 84.1 m-85 -137.81 161.31 36.91 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 1.007 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.5 tp -110.9 136.76 49.45 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.802 -174.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 2.9 t -137.85 122.95 24.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 172.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.593 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 10.3 p30 -87.57 176.07 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 119.963 -0.695 . . . . 0.0 109.728 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.516 HH12 ' HA ' ' A' ' 144' ' ' LEU . 22.9 ptt-85 -64.12 -9.79 18.69 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -165.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.54 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 66.4 t30 -88.36 7.32 33.09 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.452 -0.78 . . . . 0.0 109.518 174.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.516 ' O ' HG21 ' A' ' 15' ' ' ILE . 0.1 OUTLIER 74.83 24.45 1.6 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.914 -178.176 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.593 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 84.7 mt-10 -91.45 116.05 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.576 -172.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 126' ' ' LEU . 1.6 tm? -59.56 107.66 0.62 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.584 0.707 . . . . 0.0 109.228 174.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' SER . . . . . 1.007 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.4 m -80.99 -56.62 3.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.41 -173.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.25 18.82 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.63 ' HG3' ' CE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -104.26 167.49 9.72 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.963 178.789 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.09 51.17 Favored Glycine 0 CA--C 1.52 0.395 0 N-CA-C 114.546 0.579 . . . . 0.0 114.546 -174.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -21.7 46.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.286 0.543 . . . . 0.0 110.328 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.432 ' HB2' ' H ' ' A' ' 129' ' ' ARG . 0.9 OUTLIER -71.5 -36.17 71.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.693 173.772 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 119' ' ' LEU . 96.3 mt -69.53 129.86 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.831 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.99 95.61 5.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 11.3 t0 69.22 117.53 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 O-C-N 124.175 0.922 . . . . 0.0 111.185 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.653 HD11 HG11 ' A' ' 117' ' ' VAL . 14.9 mt -75.83 -25.76 56.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.443 -177.278 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.647 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.5 t70 -60.73 -41.1 94.65 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -70.8 -36.38 72.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.672 172.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.492 ' HB3' ' HA ' ' A' ' 136' ' ' LEU . . . -65.37 -53.35 44.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.921 0.391 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.757 HD12 HD12 ' A' ' 60' ' ' LEU . 55.6 mt -60.34 -40.91 85.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.145 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -58.35 -48.75 79.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -66.32 -20.04 65.98 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.961 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.714 HD21 ' HG ' ' A' ' 119' ' ' LEU . 66.7 mt -66.83 -39.85 87.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.413 0.625 . . . . 0.0 109.866 172.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.516 ' HA ' HH12 ' A' ' 122' ' ' ARG . 96.2 mt . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.737 177.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.676 HD11 HD13 ' A' ' 30' ' ' LEU . 15.3 tt . . . . . 0 N--CA 1.446 -0.653 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.566 ' O ' HD12 ' A' ' 30' ' ' LEU . 4.0 mp -87.65 112.66 23.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.3 108.56 4.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.175 0.512 . . . . 0.0 109.868 -177.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.404 HG12 ' CE1' ' A' ' 105' ' ' TYR . 8.5 mt -101.43 114.93 42.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.043 -178.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.574 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 79.2 mt-30 -105.58 101.11 10.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.869 -178.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.5 mt -132.22 158.28 42.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.193 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 26' ' ' ASN . 54.1 mttm -88.73 145.59 25.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.884 0.373 . . . . 0.0 111.536 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.559 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 25.9 m-20 -69.06 -177.0 0.96 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.263 174.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.536 HD23 ' SG ' ' A' ' 94' ' ' CYS . 3.5 pp -61.7 -28.48 69.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.972 0.891 . . . . 0.0 109.14 168.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.586 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 9.2 mtpm? -79.0 -7.18 57.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.024 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' ' 21' ' ' LYS . . . 81.93 16.04 73.53 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.947 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.559 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 11.6 m-20 -80.91 108.45 14.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.46 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.2 m -68.48 107.56 2.95 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.613 175.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.507 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -100.76 131.21 46.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.145 -178.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.574 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 24.5 p -102.36 161.66 13.53 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 170.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.676 HD13 HD11 ' A' ' 15' ' ' ILE . 51.1 mt -80.29 -29.02 38.17 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.556 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 p -67.5 -8.34 32.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.392 175.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -90.29 -45.14 9.24 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.471 ' CD1' ' HG2' ' A' ' 70' ' ' GLU . 1.4 mm? -67.5 -11.87 58.98 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 113.89 -1.505 . . . . 0.0 111.364 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 124' ' ' ASN . 8.7 ttpp -57.26 101.74 0.07 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.024 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 162.81 -39.95 0.35 Allowed Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.806 -1.317 . . . . 0.0 109.806 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.678 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 98.9 mttt -100.95 174.01 6.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 171.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.565 HG13 ' HD1' ' A' ' 69' ' ' PHE . 3.4 p -83.43 118.64 31.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 167.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.22 124.58 55.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.289 -167.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.465 HD11 ' CD2' ' A' ' 136' ' ' LEU . 12.2 tp -93.04 107.58 19.34 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.205 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.606 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.8 mm -84.73 106.54 14.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.585 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 28.8 t0 -101.62 129.8 47.82 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.883 -177.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -120.97 97.93 5.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.022 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.414 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -148.95 164.8 33.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.013 0.435 . . . . 0.0 111.573 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 76' ' ' LEU . 5.1 m -97.3 144.77 10.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.872 178.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.688 ' H ' ' HB3' ' A' ' 77' ' ' ASP . 7.3 m-85 -105.98 78.44 1.32 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.602 0.715 . . . . 0.0 110.436 172.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -163.15 16.82 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -144.48 131.88 20.85 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.171 -158.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.02 72.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.061 -175.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.14 -24.76 68.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 0.0 110.973 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.3 m -74.76 -27.3 60.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.094 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.52 -38.3 68.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.153 0.501 . . . . 0.0 110.231 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.07 -25.89 61.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.527 0.679 . . . . 0.0 109.802 174.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.53 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.7 t60 -75.32 -47.55 27.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.197 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.658 ' HA ' HD12 ' A' ' 57' ' ' LEU . 33.7 p30 -73.76 -21.28 60.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.86 0.362 . . . . 0.0 110.889 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.31 -57.49 12.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.804 172.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.07 75.13 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.664 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -63.21 -41.25 99.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.935 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -63.25 -31.43 72.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.329 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -74.48 -55.11 6.32 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 122.789 1.281 . . . . 0.0 108.041 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.75 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.0 -30.89 60.46 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.565 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -76.93 -46.25 24.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -62.61 -22.13 66.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.802 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -77.98 -61.61 1.94 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.194 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.564 ' OH ' ' HE3' ' A' ' 141' ' ' LYS . 96.3 m-85 -108.57 -1.43 19.65 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -164.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -68.01 170.22 8.7 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.438 176.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.2 m 71.5 -38.43 0.42 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.119 0.567 . . . . 0.0 111.08 -174.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' A' ' 65' ' ' ALA . 61.1 mt-30 -71.01 -9.81 58.66 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.457 0.646 . . . . 0.0 110.514 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.425 ' O ' HG12 ' A' ' 37' ' ' VAL . . . 117.7 34.36 1.18 Allowed Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.201 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.565 ' HD1' HG13 ' A' ' 37' ' ' VAL . 82.0 t80 -112.36 142.11 45.28 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 177.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.678 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.2 tp10 -143.17 155.34 44.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 178.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.504 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 54.7 mt -123.11 126.16 73.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.176 0.513 . . . . 0.0 109.993 175.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.553 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 78.6 t80 -112.08 100.87 9.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 31.2 tt0 -98.28 129.21 44.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.679 -175.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.408 HD11 ' HE2' ' A' ' 72' ' ' TYR . 57.2 mt -109.31 120.1 59.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.847 175.093 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 89.7 p -89.48 125.81 35.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.48 0.657 . . . . 0.0 110.336 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.423 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 14.3 mt -102.46 32.81 3.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 175.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.688 ' HB3' ' H ' ' A' ' 45' ' ' TYR . 4.6 p-10 -73.03 177.98 4.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.393 -168.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.89 26.03 4.57 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.011 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -162.89 109.36 1.19 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.466 ' HB2' HH12 ' A' ' 96' ' ' ARG . 35.1 tt0 -58.84 -40.97 85.8 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.706 -176.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -48.6 80.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.628 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -63.28 -47.85 80.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.859 0.362 . . . . 0.0 110.251 -175.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.414 ' HB2' ' HB2' ' A' ' 45' ' ' TYR . 21.5 t90 -61.1 -52.28 65.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.462 175.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.499 ' HD2' ' HB2' ' A' ' 23' ' ' LEU . 26.3 tptp -52.57 -60.26 3.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.188 -177.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.8 m -60.06 -31.53 70.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.98 -173.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.0 t -85.32 -30.71 23.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 0.0 111.533 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.564 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.9 -18.76 26.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.328 0.585 . . . . 0.0 110.617 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.405 ' OD2' ' HG3' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -65.23 -8.14 16.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.414 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -116.37 16.34 15.72 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.497 0.665 . . . . 0.0 110.206 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.564 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 37.1 mt -87.04 141.28 33.02 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 121.495 0.664 . . . . 0.0 111.575 -178.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.712 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 68.7 Cg_endo -80.22 -30.13 2.23 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 123.919 3.079 . . . . 0.0 112.956 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.712 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.2 p90 -102.16 -169.28 1.65 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.258 -172.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.553 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 44.9 t -77.79 133.17 31.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.882 -176.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.536 ' SG ' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -140.63 95.48 2.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.431 0.634 . . . . 0.0 110.399 -176.12 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.487 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 18.0 m -113.79 170.27 4.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.158 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.466 HH12 ' HB2' ' A' ' 80' ' ' GLU . 38.0 ttp180 -126.19 138.31 53.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.599 0.238 . . . . 0.0 111.039 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -81.1 157.59 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.027 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.56 -23.3 37.27 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -175.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -122.59 -11.71 8.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.646 0.26 . . . . 0.0 111.642 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 71.23 -121.1 8.85 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.606 -0.806 . . . . 0.0 111.853 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.26 -14.93 62.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.984 0.421 . . . . 0.0 110.928 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -95.88 12.25 30.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.566 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.488 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.2 t -65.97 141.59 58.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.78 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.8 m -69.82 -24.03 63.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.202 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.404 ' CE1' HG12 ' A' ' 18' ' ' ILE . 63.7 m-85 -59.56 -47.66 84.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.488 HG13 ' HB3' ' A' ' 103' ' ' SER . 32.5 mt -57.99 -36.67 57.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.281 -176.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.8 m -68.93 -27.22 65.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.283 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.5 -27.15 64.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.753 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -87.17 1.53 52.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.64 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.975 0 C-N-CA 123.74 0.816 . . . . 0.0 111.182 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 27.7 mt . . . . . 0 C--O 1.233 0.21 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 63.1 Cg_endo -71.7 156.09 97.46 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.853 -1.311 . . . . 0.0 113.017 0.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.48 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 5.9 m -146.16 173.74 11.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.263 -177.187 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.406 HG11 HD21 ' A' ' 136' ' ' LEU . 2.4 p -129.59 161.33 39.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.034 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.606 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.5 m-85 -137.6 157.78 45.78 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 174.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.891 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 6.8 tp -110.96 139.35 46.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -175.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.0 t -135.62 121.02 29.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.552 0.215 . . . . 0.0 110.964 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -76.39 164.15 26.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 34.1 mtt180 -52.3 -18.59 1.64 Allowed 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.155 0.91 . . . . 0.0 113.319 -169.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -84.74 6.25 25.08 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.505 ' HB2' ' HB2' ' A' ' 34' ' ' LYS . 30.4 t30 63.0 52.23 2.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.538 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 49.5 mt-10 -127.22 143.57 51.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.422 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.0 tt -68.85 109.81 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.306 0.574 . . . . 0.0 110.176 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.891 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 58.1 m -76.82 -53.96 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.291 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -162.54 153.83 17.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 -177.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.587 ' O ' HG13 ' A' ' 133' ' ' ILE . 91.7 mtt180 -89.28 156.81 18.5 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.328 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.16 -26.14 60.9 Favored Glycine 0 C--O 1.225 -0.463 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -71.64 -11.78 61.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.443 0.639 . . . . 0.0 110.393 177.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -115.67 -37.22 4.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.069 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.77 HG21 ' HG ' ' A' ' 136' ' ' LEU . 42.7 mt -68.65 145.97 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -128.94 -43.02 1.36 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -130.78 111.92 12.58 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.552 173.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.77 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.8 mp -77.67 -30.48 52.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.963 -178.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -48.38 -57.83 5.49 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.609 0.568 . . . . 0.0 110.529 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.625 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 37.5 mm-40 -58.84 -43.02 90.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.935 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.506 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -60.76 -43.14 98.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.341 -175.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.75 HD12 HD12 ' A' ' 60' ' ' LEU . 40.7 mt -57.89 -44.43 86.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.717 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 138' ' ' GLU . 22.7 mttt -51.1 -55.42 17.78 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.447 0.642 . . . . 0.0 111.234 176.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.625 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 2.6 ptpt -74.2 -18.07 60.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.228 -0.897 . . . . 0.0 112.353 -173.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -83.71 -40.06 19.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.64 0.257 . . . . 0.0 111.245 173.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 71.8 mt . . . . . 0 CA--C 1.52 -0.202 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.8 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.644 HG21 ' O ' ' A' ' 124' ' ' ASN . 7.7 pt . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.465 ' O ' HD12 ' A' ' 30' ' ' LEU . 89.0 mt -108.55 113.86 45.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 173.098 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -98.5 108.55 21.27 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 mt -94.4 121.43 45.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.714 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.573 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 32.3 mt-30 -119.04 100.77 7.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.49 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.1 mt -135.3 154.46 51.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 93.0 mttt -79.16 141.62 37.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.159 0.504 . . . . 0.0 110.894 -176.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.63 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 4.0 p-10 -88.45 -169.02 2.39 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.902 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.443 HD13 ' HB3' ' A' ' 87' ' ' ALA . 49.3 tp -52.99 -37.83 61.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.702 177.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -71.2 -27.79 63.75 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -177.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.26 18.52 14.61 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.504 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.403 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 21.7 m120 -108.27 127.9 54.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 178.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.609 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.7 m -63.12 110.6 1.89 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.383 0.611 . . . . 0.0 110.856 178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.573 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 21.3 mmm180 -86.15 134.85 33.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.967 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.1 p -118.5 155.91 30.0 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 173.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.594 HD22 HG11 ' A' ' 38' ' ' VAL . 71.9 mt -73.29 -23.14 60.26 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 p -71.82 -0.92 12.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.72 175.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -98.11 -47.11 5.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.954 0.407 . . . . 0.0 110.882 178.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' A' ' 38' ' ' VAL . 0.6 OUTLIER -91.9 24.72 3.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.71 0.767 . . . . 0.0 109.41 175.334 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.605 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 59.4 tttp -55.92 -42.95 76.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.983 -1.462 . . . . 0.0 112.524 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.16 3.45 38.49 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 115.786 -0.643 . . . . 0.0 113.478 -176.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 6.6 mppt? -125.47 168.81 13.1 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.761 HG21 HD23 ' A' ' 144' ' ' LEU . 45.5 t -73.19 124.91 31.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' A' ' 33' ' ' LEU . 46.7 t -109.01 124.39 65.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.387 0.613 . . . . 0.0 111.462 -169.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.457 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.2 tp -97.35 133.61 41.72 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 171.379 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.592 HG13 ' HB2' ' A' ' 118' ' ' PHE . 1.1 pt -118.1 106.9 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.185 0.517 . . . . 0.0 110.873 175.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.474 ' HB2' ' HA ' ' A' ' 73' ' ' GLN . 13.8 m-20 -98.22 133.28 42.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.858 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -117.33 97.32 5.84 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.459 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 11.1 t -143.7 179.27 7.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 -175.023 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.668 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -126.02 124.29 65.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 120.725 0.298 . . . . 0.0 110.325 -178.879 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.71 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 28.8 m-85 -74.98 79.43 2.18 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.235 0.54 . . . . 0.0 110.006 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 41.3 t30 172.95 -32.33 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.366 -1.288 . . . . 0.0 108.661 174.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.668 ' HB2' HG13 ' A' ' 44' ' ' VAL . 37.4 t-20 -65.1 133.89 52.6 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.852 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -30.8 69.28 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.529 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 90.0 mtp -67.94 -22.54 65.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.347 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -71.14 -23.33 62.05 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.288 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.81 18.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.848 0.356 . . . . 0.0 110.718 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.04 -39.31 93.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.69 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.482 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.3 t60 -62.85 -45.12 94.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.991 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.659 ' HA ' HD12 ' A' ' 57' ' ' LEU . 0.9 OUTLIER -74.7 -22.17 58.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.782 -176.923 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.471 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -68.58 -43.57 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.36 -38.88 81.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.737 174.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 54' ' ' ASN . 86.7 mt -62.51 -42.29 99.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.001 177.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.471 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.4 tpm_? -54.84 -36.03 64.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.777 176.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -79.97 -50.29 10.63 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -173.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.854 HD12 HD12 ' A' ' 140' ' ' ILE . 2.7 mm? -55.77 -30.72 61.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 113.271 -1.786 . . . . 0.0 111.429 178.41 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -72.72 -48.38 39.24 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.231 0.539 . . . . 0.0 109.685 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -63.38 -21.18 66.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.643 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.564 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 33.5 mttm -82.21 -61.32 1.93 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.925 -178.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.498 ' HB3' HD11 ' A' ' 144' ' ' LEU . 83.8 m-85 -113.35 -5.85 13.55 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -164.015 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.592 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.15 -34.9 75.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.248 0.476 . . . . 0.0 111.585 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 m -63.17 -22.07 66.62 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.775 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -98.57 18.59 16.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.701 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.04 54.43 1.62 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.344 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.592 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 54.0 t80 -132.29 125.9 32.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.71 0.29 . . . . 0.0 110.274 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.461 ' HB3' HD12 ' A' ' 33' ' ' LEU . 28.9 tt0 -125.36 154.73 41.4 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.583 ' HB ' ' CB ' ' A' ' 92' ' ' TRP . 49.8 mt -118.8 126.32 75.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.06 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.497 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 75.7 t80 -112.78 100.12 8.43 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.275 -0.875 . . . . 0.0 108.859 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.474 ' HA ' ' HB2' ' A' ' 41' ' ' ASP . 42.2 tt0 -102.48 126.32 49.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.348 -175.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 54.9 mt -103.56 129.09 56.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.339 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.71 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 3.8 p -95.85 131.63 41.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.487 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 22.2 mt -116.45 33.67 5.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.24 0.543 . . . . 0.0 109.741 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.5 ' OD2' ' HB2' ' A' ' 75' ' ' SER . 3.5 p30 -85.29 -165.91 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.752 -175.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -135.5 30.16 2.81 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.779 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -151.36 101.93 2.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.993 0.425 . . . . 0.0 110.632 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -64.98 -31.76 73.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.653 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -46.0 90.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.564 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -71.97 -42.02 67.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.834 0.349 . . . . 0.0 110.6 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 36.9 t90 -60.77 -48.38 82.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.747 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.465 ' HB2' ' HE3' ' A' ' 84' ' ' LYS . 37.2 ttmt -62.18 -42.14 98.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.806 -175.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 7.9 p -71.22 -40.15 71.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.831 0.348 . . . . 0.0 111.264 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.53 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 25.3 t -69.9 -45.62 67.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.713 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.443 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -66.95 -26.32 66.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.622 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.404 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 27.7 t70 -61.85 -31.34 71.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.763 0.315 . . . . 0.0 111.071 -178.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -102.64 7.86 39.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.935 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 86' ' ' SER . 40.0 mt -94.74 140.62 22.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.233 0.54 . . . . 0.0 111.339 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.62 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.2 Cg_endo -72.45 -49.3 0.28 Allowed 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 123.875 3.05 . . . . 0.0 113.938 -174.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.62 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.1 p90 -81.88 -172.31 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.984 0.421 . . . . 0.0 111.933 -173.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.439 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 90.6 t -85.8 117.52 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.357 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 34.1 m -113.68 108.8 17.61 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.911 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.63 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 23.2 m -114.77 172.1 4.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.934 -179.562 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -133.04 140.37 47.68 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.085 -177.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -93.03 151.0 20.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.06 -18.52 42.84 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -115.82 -12.17 11.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.812 0.339 . . . . 0.0 111.033 -175.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.487 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 66.41 -121.29 17.43 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.074 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.62 -6.81 43.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.765 0.316 . . . . 0.0 111.303 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -100.97 15.8 27.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.428 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.442 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.6 t -63.6 132.68 51.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.172 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.5 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 16.5 m -59.38 -28.95 67.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.172 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -60.79 -45.42 94.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.735 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.442 HG13 ' HB3' ' A' ' 103' ' ' SER . 43.2 mt -58.0 -36.2 55.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.113 0.482 . . . . 0.0 110.433 -177.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -72.67 -39.66 66.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.535 177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.7 mt -64.26 -32.12 73.58 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.573 -178.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -69.99 -27.3 64.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.947 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.1 t-20 . . . . . 0 C--N 1.328 -0.338 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 -164.575 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 115' ' ' PRO . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.613 ' HA ' HD23 ' A' ' 114' ' ' LEU . 33.6 Cg_endo -63.83 139.97 36.87 Favored 'Cis proline' 0 C--N 1.354 0.858 0 C-N-CA 124.371 -1.096 . . . . 0.0 113.433 1.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.11 177.6 7.33 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.98 -177.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 7.9 p -138.05 159.25 33.09 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.647 ' HE2' ' HD2' ' A' ' 129' ' ' ARG . 86.2 m-85 -138.04 163.27 32.02 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.41 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 1.025 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.4 tp -110.98 135.03 52.1 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.745 -174.514 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 49.1 t -131.18 117.53 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.32 0.581 . . . . 0.0 110.301 172.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.463 ' HA ' HD13 ' A' ' 143' ' ' LEU . 31.4 t30 -70.84 161.15 31.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 122' ' ' ARG . 17.0 ptt180 -73.88 29.68 0.08 Allowed 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -170.036 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.541 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 4.4 t-20 -120.37 2.97 10.83 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 169.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.644 ' O ' HG21 ' A' ' 15' ' ' ILE . 0.2 OUTLIER 69.28 62.78 0.29 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.709 -167.016 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.541 ' HG3' ' HB3' ' A' ' 123' ' ' ASN . 38.3 mt-10 -122.2 123.81 42.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.019 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 tt -62.04 106.8 0.76 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 171.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' SER . . . . . 1.025 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 47.0 m -83.08 -54.7 4.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.972 -172.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -167.66 172.13 9.58 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.755 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.647 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 19.6 mmt85 -78.62 175.39 10.43 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -80.63 -26.62 53.65 Favored Glycine 0 C--N 1.315 -0.585 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.616 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.459 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 mp0 -75.47 -41.85 54.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.164 0.507 . . . . 0.0 112.021 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.623 HD22 ' H ' ' A' ' 129' ' ' ARG . 12.5 p30 -81.03 -6.58 58.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.704 -176.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.645 HG21 ' HG ' ' A' ' 136' ' ' LEU . 63.3 mt -85.61 110.26 19.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.313 0.578 . . . . 0.0 109.975 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -61.01 -25.36 66.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.026 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 137' ' ' ASP . 36.2 t70 -173.05 116.48 0.28 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.645 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.4 mp -75.17 -28.52 60.11 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.924 -0.311 . . . . 0.0 111.043 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.471 ' HB3' ' OD2' ' A' ' 135' ' ' ASP . 9.3 t70 -53.51 -54.93 30.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 173.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.22 -48.55 68.07 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.666 172.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.509 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -64.24 -52.12 60.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.373 -172.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.854 HD12 HD12 ' A' ' 60' ' ' LEU . 37.6 mt -61.3 -36.83 75.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.275 0.56 . . . . 0.0 110.295 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 17.2 ttpt -60.11 -40.0 88.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.149 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 139' ' ' ALA . 17.1 ptpt -85.02 -19.73 31.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.244 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.515 HD11 ' HG ' ' A' ' 119' ' ' LEU . 16.0 mt -75.15 -32.83 61.43 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.682 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.761 HD23 HG21 ' A' ' 37' ' ' VAL . 34.0 mt . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.518 178.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.3 tp . . . . . 0 N--CA 1.448 -0.558 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.454 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.1 mp -98.9 104.56 16.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.11 110.9 2.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.288 0.566 . . . . 0.0 110.093 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.465 HG21 ' CD1' ' A' ' 74' ' ' ILE . 25.1 mm -90.4 108.6 19.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.259 -178.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.626 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 19.4 mt-30 -105.31 99.8 9.4 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.192 0.52 . . . . 0.0 110.795 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.2 mt -138.35 159.0 43.19 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.647 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 46.0 mtmt -89.69 138.18 31.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.737 0.779 . . . . 0.0 111.395 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.636 ' OD1' ' HG ' ' A' ' 23' ' ' LEU . 9.9 t70 -71.09 169.04 15.85 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.819 -1.537 . . . . 0.0 109.821 176.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.848 HD13 ' HA ' ' A' ' 88' ' ' ASP . 2.5 pp -51.82 -34.68 41.34 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.695 0.759 . . . . 0.0 111.212 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -69.34 -6.91 32.76 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.115 177.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.53 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 89.74 7.91 68.18 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.308 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -101.69 118.29 36.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.553 0.216 . . . . 0.0 111.487 -175.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.647 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 24.3 m -58.28 124.01 18.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.223 0.535 . . . . 0.0 110.839 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.626 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.3 mmm180 -107.03 142.98 35.8 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.563 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.5 p -120.17 162.34 19.51 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.461 ' HG ' ' H ' ' A' ' 18' ' ' ILE . 49.9 mt -80.1 -29.65 39.07 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.3 p -59.33 -22.89 61.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.701 173.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -85.5 -52.56 5.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.153 176.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -13.98 11.52 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.221 -178.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.613 ' NZ ' ' HB3' ' A' ' 34' ' ' LYS . 3.6 ttpm? -53.48 -14.98 0.91 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.224 1.01 . . . . 0.0 112.475 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.53 ' C ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.1 -16.37 59.8 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.651 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.53 ' HD2' ' C ' ' A' ' 35' ' ' GLY . 2.9 mptp? -136.14 -178.9 5.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 110.397 176.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.719 HG21 HD23 ' A' ' 144' ' ' LEU . 56.3 t -78.58 123.29 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 172.063 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.1 t -103.32 122.27 55.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.308 0.575 . . . . 0.0 112.204 -163.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.785 HD11 HD21 ' A' ' 136' ' ' LEU . 13.0 tp -92.06 122.13 34.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.739 171.405 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.534 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.0 mm -98.98 106.03 18.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.714 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 25.6 t70 -108.4 131.07 55.14 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.869 -178.53 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.511 ' HD2' HD11 ' A' ' 76' ' ' LEU . 32.7 m-85 -119.63 97.77 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.106 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.583 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.2 t -137.39 164.87 27.58 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.996 0.427 . . . . 0.0 111.233 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.597 HG23 ' HB2' ' A' ' 47' ' ' ASN . 3.4 m -102.49 116.75 46.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.051 0.453 . . . . 0.0 110.437 177.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' A' ' 83' ' ' TRP . 7.4 m-85 -74.89 84.13 2.2 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.699 0.761 . . . . 0.0 109.057 175.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 177.69 -37.81 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.149 -165.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.597 ' HB2' HG23 ' A' ' 44' ' ' VAL . 10.1 t-20 -89.76 146.56 24.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.383 -169.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.31 -30.77 71.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.724 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.3 mmm -64.27 -27.19 68.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.793 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.9 m -69.33 -28.25 66.07 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.164 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.72 -55.7 15.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.866 0.365 . . . . 0.0 110.67 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.03 77.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.623 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.495 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 67.8 t60 -66.13 -38.25 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.454 178.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.447 ' HA ' HD12 ' A' ' 57' ' ' LEU . 4.3 t30 -66.95 -39.45 87.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.455 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -57.34 -50.23 73.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.501 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.03 83.8 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.005 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.4 mt -62.97 -42.38 99.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 109.943 175.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -61.68 -28.83 69.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.023 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -72.28 -53.25 13.02 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.708 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -56.56 -32.1 64.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 112.345 -2.207 . . . . 0.0 111.072 176.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -73.1 -47.66 42.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.119 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -61.93 -22.46 65.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.263 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -79.7 -55.83 4.72 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.666 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.611 ' HB3' HD11 ' A' ' 144' ' ' LEU . 93.6 m-85 -118.09 -11.4 10.18 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -165.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.528 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -56.33 -42.87 78.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -174.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.3 p -54.2 -43.48 70.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.414 -176.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -69.69 -33.21 72.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 151.81 47.74 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.303 -0.951 . . . . 0.0 112.582 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.644 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 66.9 t80 -127.92 138.77 52.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.359 -0.238 . . . . 0.0 110.359 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.36 155.56 49.25 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.454 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 46.3 mt -116.84 114.97 47.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.446 0.641 . . . . 0.0 110.503 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 87.7 t80 -100.48 101.3 12.21 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.606 178.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.714 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 10.7 mt-30 -94.86 143.18 26.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.031 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.465 ' CD1' HG21 ' A' ' 18' ' ' ILE . 57.3 mt -127.21 124.88 65.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.715 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.627 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 10.7 p -92.49 129.91 38.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.947 0.403 . . . . 0.0 111.116 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.511 HD11 ' HD2' ' A' ' 42' ' ' PHE . 25.1 mt -112.45 10.5 19.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.88 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.627 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 3.9 p-10 -69.22 -49.99 51.32 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.322 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.94 -34.54 3.24 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.632 176.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -87.04 136.36 32.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.934 0.874 . . . . 0.0 111.367 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 44.1 tt0 -78.7 -29.0 45.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.7 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -79.59 -50.6 10.45 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.286 -167.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -65.44 -39.31 91.9 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.498 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 16.0 t90 -61.99 -47.93 82.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.792 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.698 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 46.2 tttm -68.34 -49.72 58.33 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.968 -176.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.6 p -58.93 -30.31 67.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.202 0.525 . . . . 0.0 111.423 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.1 m -82.84 -46.22 13.32 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.684 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.512 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.24 -18.8 27.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -171.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.848 ' HA ' HD13 ' A' ' 23' ' ' LEU . 3.6 t70 -55.36 -33.56 63.52 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.93 0.492 . . . . 0.0 111.981 -170.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -104.26 11.72 34.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.145 -176.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.512 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 23.3 mt -81.83 157.7 68.86 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 121.121 0.486 . . . . 0.0 111.712 -176.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.624 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 72.1 Cg_endo -69.8 -44.41 2.07 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.744 2.963 . . . . 0.0 114.208 -176.172 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.624 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -100.75 -170.69 1.89 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 112.005 -171.425 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.559 HG11 ' HG3' ' A' ' 28' ' ' ARG . 90.3 t -83.79 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.775 -176.083 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 84.0 m -136.17 108.81 7.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.07 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.428 HG12 ' CA ' ' A' ' 22' ' ' ASP . 14.6 m -113.89 159.8 13.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.009 -177.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 80' ' ' GLU . 12.2 ttp180 -117.73 134.42 54.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.379 -177.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -92.69 143.56 26.18 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.35 -14.09 55.84 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -99.95 -13.31 19.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.744 -172.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.41 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . 64.62 -98.45 0.28 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.747 178.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -105.92 1.49 26.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.956 0.408 . . . . 0.0 110.891 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -104.56 9.47 35.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.119 0.485 . . . . 0.0 110.193 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.534 ' HB2' HG13 ' A' ' 106' ' ' ILE . 4.2 m -65.27 122.21 16.59 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.554 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.543 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.3 m -55.17 -27.1 43.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.867 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -55.59 -47.24 76.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.613 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.534 HG13 ' HB2' ' A' ' 103' ' ' SER . 53.1 mt -57.07 -34.77 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.765 -176.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.9 m -77.17 -37.27 54.11 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 177.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 104' ' ' SER . 96.7 mt -63.58 -37.65 88.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.599 -178.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -71.53 -24.41 61.94 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.412 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 . . . . . 0 C--N 1.331 -0.202 0 CA-C-O 122.1 0.953 . . . . 0.0 108.758 -165.398 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.469 HD13 ' OG ' ' A' ' 116' ' ' SER . 3.7 mm? . . . . . 0 N--CA 1.465 0.28 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.97 143.02 74.8 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 123.86 -1.308 . . . . 0.0 112.919 0.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.469 ' OG ' HD13 ' A' ' 114' ' ' LEU . 13.3 m -121.04 169.99 9.96 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.464 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.8 p -142.25 156.71 19.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.534 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.7 m-85 -140.23 160.16 40.57 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.921 HD13 HD11 ' A' ' 136' ' ' LEU . 13.9 tp -111.0 134.93 52.21 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -174.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.49 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.6 t -135.51 120.44 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.775 0.321 . . . . 0.0 110.554 177.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.641 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.1 p30 -77.74 167.56 21.36 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 4.68 0.78 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -168.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -95.65 5.3 51.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 35.1 t30 64.42 48.05 2.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.277 -172.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.641 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 42.4 mt-10 -119.12 136.85 53.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.615 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.86 118.05 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.324 0.583 . . . . 0.0 110.801 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.619 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 18.4 m -87.31 -53.45 4.83 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.877 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.09 169.14 14.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.172 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.47 ' O ' HG13 ' A' ' 133' ' ' ILE . 93.4 mtt180 -91.7 168.33 11.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.885 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -65.16 -36.55 93.03 Favored Glycine 0 CA--C 1.509 -0.316 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.463 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 pm0 -75.93 -0.14 20.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.086 0.469 . . . . 0.0 111.125 177.001 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -110.07 -19.47 13.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.167 0.508 . . . . 0.0 110.05 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.535 HD11 ' HB2' ' A' ' 119' ' ' LEU . 97.2 mt -82.9 108.3 15.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.73 -177.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.78 ' HD2' ' H ' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -82.99 -26.34 31.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.955 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -161.36 110.43 1.58 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.921 HD11 HD13 ' A' ' 119' ' ' LEU . 2.8 tp -76.78 -33.17 58.05 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.754 -175.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.456 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.1 t70 -51.54 -52.83 43.81 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.48 177.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.543 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 28.7 mm-40 -56.57 -52.22 65.64 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.64 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.468 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.97 -50.6 71.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.183 -172.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.708 HD12 HD12 ' A' ' 60' ' ' LEU . 52.2 mt -59.55 -40.54 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.213 0.53 . . . . 0.0 110.249 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.428 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 29.4 ttpt -56.78 -47.59 79.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.016 178.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.543 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 11.5 ptpt -81.54 -18.88 43.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.76 -176.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 40.2 mt -71.91 -39.59 69.42 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 110.401 173.147 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.719 HD23 HG21 ' A' ' 37' ' ' VAL . 66.6 mt . . . . . 0 N--CA 1.453 -0.306 0 CA-C-O 121.504 0.669 . . . . 0.0 109.938 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.4 tp . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 120.982 0.42 . . . . 0.0 110.718 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.528 ' O ' HD12 ' A' ' 30' ' ' LEU . 4.2 mp -101.69 126.23 55.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -80.03 108.02 13.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.491 HD11 ' OH ' ' A' ' 109' ' ' TYR . 11.1 mt -96.07 125.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.729 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.612 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 28.9 mt-30 -118.73 99.96 7.11 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.985 0.421 . . . . 0.0 110.365 -178.213 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.7 mt -133.63 156.46 47.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 95.4 mttt -87.64 139.63 30.34 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.053 0.454 . . . . 0.0 111.308 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.584 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 7.8 p30 -87.82 -167.22 1.81 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.892 -176.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.578 HD13 ' HB3' ' A' ' 87' ' ' ALA . 55.3 tp -50.02 -36.15 27.63 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.272 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.618 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 8.9 mtmp? -84.87 -5.53 59.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.497 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.88 17.48 63.27 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -176.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -97.08 117.26 30.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.209 -0.496 . . . . 0.0 110.275 -177.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.589 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 54.7 m -61.74 118.94 7.8 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.153 0.501 . . . . 0.0 111.269 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.612 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.9 mmm180 -101.38 139.17 37.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.498 176.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 36.8 p -118.06 161.89 19.09 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 172.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 16' ' ' ILE . 58.0 mt -79.88 -21.29 44.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.642 0.734 . . . . 0.0 109.863 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.35 -8.21 52.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.625 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -89.94 -60.51 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.994 0.426 . . . . 0.0 110.512 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.41 ' CD2' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -77.96 9.18 3.81 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 121.782 0.801 . . . . 0.0 111.066 -177.265 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.497 ' NZ ' ' HB3' ' A' ' 124' ' ' ASN . 24.1 ttmm -54.75 141.45 32.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.477 171.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.64 -25.53 8.5 Favored Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 -173.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.499 ' NZ ' ' HB2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -120.96 170.62 9.33 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.287 173.346 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.675 HG13 ' HG2' ' A' ' 122' ' ' ARG . 1.6 m -79.95 134.71 26.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.481 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 41.3 t -117.02 130.98 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-O 121.184 0.516 . . . . 0.0 111.155 -170.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.54 ' HB3' HG23 ' A' ' 71' ' ' ILE . 11.8 tp -94.96 107.52 19.56 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.649 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.687 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.8 mm -85.6 105.49 14.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.133 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.438 ' CG ' ' HE2' ' A' ' 53' ' ' HIS . 1.8 t70 -107.18 131.6 53.97 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.287 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -116.03 97.32 6.01 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.734 ' O ' ' HA ' ' A' ' 75' ' ' SER . 22.7 m -144.63 147.32 32.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.182 0.515 . . . . 0.0 111.161 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.556 HG13 ' HB2' ' A' ' 47' ' ' ASN . 1.6 p -95.46 123.01 47.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 122.236 -0.29 . . . . 0.0 110.946 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.691 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 30.5 m-85 -82.69 79.07 9.2 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.01 0.91 . . . . 0.0 109.659 175.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.424 ' HB3' HG22 ' A' ' 44' ' ' VAL . 7.3 t-20 -178.13 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 113.569 -1.65 . . . . 0.0 109.078 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.556 ' HB2' HG13 ' A' ' 44' ' ' VAL . 30.0 t-20 -71.85 142.86 49.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.558 -178.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.07 -30.12 69.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.822 -175.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 21.8 ptp -71.45 -17.06 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.0 0.429 . . . . 0.0 111.088 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.2 m -71.17 -30.58 66.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.517 -177.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.61 -47.31 86.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.878 0.371 . . . . 0.0 111.137 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.133 0.492 . . . . 0.0 110.646 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.483 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.5 t60 -68.12 -40.89 82.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.625 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.539 ' HA ' HD12 ' A' ' 57' ' ' LEU . 92.5 m-20 -63.65 -34.01 76.91 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.792 0.33 . . . . 0.0 111.05 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.11 -53.75 54.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.415 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.54 -35.59 76.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.06 -178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.539 HD12 ' HA ' ' A' ' 54' ' ' ASN . 86.8 mt -64.17 -41.55 97.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.515 0.674 . . . . 0.0 109.69 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 58' ' ' ARG . 28.5 tpt85 -64.56 -27.34 68.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.094 -178.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.474 ' OE2' ' HE3' ' A' ' 63' ' ' LYS . 3.7 tm-20 -75.54 -56.16 4.97 Favored 'General case' 0 CA--C 1.489 -1.385 0 CA-C-O 123.003 1.382 . . . . 0.0 107.801 -174.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.546 HD12 HD12 ' A' ' 140' ' ' ILE . 3.0 mm? -55.02 -29.33 57.15 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 111.819 -2.446 . . . . 0.0 111.067 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -66.86 -49.17 66.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.24 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.34 -26.38 66.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.713 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.474 ' HE3' ' OE2' ' A' ' 59' ' ' GLU . 74.2 mttt -77.02 -61.48 1.97 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.685 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -109.54 -11.84 14.75 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -164.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.587 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.53 -37.9 82.69 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.189 0.45 . . . . 0.0 111.494 -177.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.4 m -65.11 -13.87 59.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.839 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -101.39 6.64 42.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.087 0.47 . . . . 0.0 110.955 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.51 54.24 0.89 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.175 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.594 ' HD1' HG23 ' A' ' 37' ' ' VAL . 37.2 t80 -130.57 131.66 45.13 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 178.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -130.69 156.15 45.4 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.601 HD12 ' CE3' ' A' ' 92' ' ' TRP . 43.6 mt -122.34 129.13 75.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-O 120.995 0.426 . . . . 0.0 110.152 -175.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.484 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 89.8 t80 -113.27 100.4 8.54 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.237 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.79 140.99 29.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.819 -177.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.46 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 59.9 mt -127.16 107.8 17.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.606 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.734 ' HA ' ' O ' ' A' ' 43' ' ' THR . 0.0 OUTLIER -77.77 129.44 35.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.998 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.462 ' H ' ' HA ' ' A' ' 44' ' ' VAL . 48.2 mt -110.34 38.75 2.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.553 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.1 p30 -100.72 -178.77 3.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.449 -175.58 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 -25.64 4.8 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.481 173.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.607 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 30.4 t70 -103.14 97.47 7.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.997 0.427 . . . . 0.0 110.689 -177.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.662 ' HB3' ' CZ ' ' A' ' 96' ' ' ARG . 10.0 pt-20 -74.79 -13.99 60.65 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.622 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' HIS . . . . . 0.607 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.2 OUTLIER -52.07 -50.59 61.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.403 173.367 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -70.81 -39.68 72.94 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.165 0.507 . . . . 0.0 110.553 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.616 ' HE3' ' HB2' ' A' ' 80' ' ' GLU . 31.4 t90 -60.27 -46.58 89.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.077 176.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -64.43 -43.73 93.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.281 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.7 p -69.45 -39.06 77.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.5 t -72.87 -37.41 67.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.599 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.611 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -70.17 -23.09 62.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.091 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.03 -27.08 68.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.708 0.766 . . . . 0.0 110.329 174.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -102.46 12.52 36.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.995 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.499 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 24.8 mt -97.98 147.35 32.95 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 121.408 0.623 . . . . 0.0 112.215 -177.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.765 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 14.8 Cg_endo -100.21 3.33 0.8 Allowed 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 124.495 3.463 . . . . 0.0 114.168 -176.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.765 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 2.4 p90 -136.72 -170.09 2.61 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.219 -0.301 . . . . 0.0 111.047 -174.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.486 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 78.7 t -80.89 127.02 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.945 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.611 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 1.6 p -129.63 103.38 6.82 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.209 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.584 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 6.4 m -114.73 156.24 15.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.662 ' CZ ' ' HB3' ' A' ' 80' ' ' GLU . 12.6 ttp180 -120.91 139.06 53.75 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.347 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -89.24 148.54 23.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.59 -16.4 51.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 0.0 111.697 -176.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -107.34 -12.15 15.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.17 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.43 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 62.31 -120.69 22.86 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.014 -177.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.48 -5.73 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.356 . . . . 0.0 111.476 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -99.6 12.87 35.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.525 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.419 ' HB3' HG13 ' A' ' 106' ' ' ILE . 42.9 t -64.9 133.53 52.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.798 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.2 m -63.31 -25.1 68.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.796 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -60.63 -44.15 96.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.353 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.419 HG13 ' HB3' ' A' ' 103' ' ' SER . 65.3 mt -56.73 -41.3 74.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.989 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.5 m -66.12 -27.81 68.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.965 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -73.9 -18.27 60.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.04 -179.168 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.491 ' OH ' HD11 ' A' ' 18' ' ' ILE . 87.8 m-85 -98.27 0.73 46.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.45 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.769 0 O-C-N 123.972 0.795 . . . . 0.0 110.501 -177.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.509 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 46.8 mt . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.509 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 17.3 Cg_exo -67.61 152.59 85.96 Favored 'Cis proline' 0 C--N 1.354 0.847 0 C-N-CA 123.442 -1.483 . . . . 0.0 111.934 0.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.444 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 68.7 m -151.21 175.84 11.78 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.034 0.445 . . . . 0.0 111.149 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.454 HG11 HD21 ' A' ' 136' ' ' LEU . 4.4 p -132.66 161.11 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.095 179.18 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.687 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.2 m-85 -137.42 162.02 34.76 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.921 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 11.9 tp -109.61 135.84 49.93 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.725 -176.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.541 ' CG1' ' HA ' ' A' ' 124' ' ' ASN . 4.0 t -129.84 125.63 61.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.227 0.537 . . . . 0.0 110.654 174.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.546 ' HA ' HG12 ' A' ' 37' ' ' VAL . 28.7 t30 -80.77 167.97 19.34 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.402 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.675 ' HG2' HG13 ' A' ' 37' ' ' VAL . 16.4 mtp180 -56.48 -25.15 50.23 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -165.216 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.711 ' HB2' ' CD ' ' A' ' 125' ' ' GLU . 90.4 m-20 -90.01 13.16 15.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -177.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.541 ' HA ' ' CG1' ' A' ' 120' ' ' VAL . 2.8 t-20 60.48 57.55 2.77 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.407 -172.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.711 ' CD ' ' HB2' ' A' ' 123' ' ' ASN . 2.2 mp0 -109.33 134.91 51.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.178 175.028 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.42 107.08 2.31 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.921 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -78.78 -50.78 10.75 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.36 -173.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.09 167.31 10.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.5 -178.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.602 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -94.58 154.58 17.3 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.547 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -51.5 -41.33 48.8 Favored Glycine 0 C--N 1.33 0.231 0 O-C-N 123.434 0.458 . . . . 0.0 113.871 -175.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.463 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.6 OUTLIER -71.36 -18.09 62.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.897 0.38 . . . . 0.0 110.655 -178.016 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -101.43 -15.14 17.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.719 -176.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.851 HG21 ' HG ' ' A' ' 136' ' ' LEU . 90.0 mt -77.08 99.84 2.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.163 0.506 . . . . 0.0 110.387 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.5 ptmt -74.31 87.77 2.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.202 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.415 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 33.8 t70 69.54 116.3 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.376 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.851 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.1 mp -76.13 -33.57 59.42 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.123 -177.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.519 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.3 t70 -54.15 -59.72 4.28 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.588 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 0.7 OUTLIER -51.89 -46.43 64.52 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.404 173.268 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.617 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.48 -51.71 68.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.033 0.382 . . . . 0.0 112.033 -174.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 136' ' ' LEU . 47.7 mt -57.64 -43.43 83.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.155 0.502 . . . . 0.0 110.081 177.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -59.66 -50.83 72.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.951 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.617 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 24.9 pttt -73.35 -17.13 61.32 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 42.9 mt -70.62 -40.72 72.99 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 169.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.076 175.353 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.449 -0.478 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.424 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.3 mp -89.19 114.49 27.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.01 121.83 18.18 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.17 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.477 HD11 ' OH ' ' A' ' 109' ' ' TYR . 9.4 mt -105.07 106.83 21.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.675 -174.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.436 ' CG ' ' HB3' ' A' ' 29' ' ' SER . 19.2 mt-30 -102.05 100.43 10.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.024 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.527 HD22 ' HA ' ' A' ' 97' ' ' ASP . 43.9 mt -138.38 156.7 47.35 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.3 mtmt -99.98 153.84 18.87 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 120.58 -0.448 . . . . 0.0 111.584 -172.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.76 -166.4 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.884 -174.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.543 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 6.3 mp -53.61 -46.77 70.54 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.729 177.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -68.32 -44.76 74.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.974 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.479 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 124.7 19.53 2.49 Favored Glycine 0 N--CA 1.44 -1.084 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.79 -176.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -92.32 119.73 32.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.585 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 45.5 m -64.93 127.83 33.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.99 0.424 . . . . 0.0 111.31 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.2 mmm180 -108.84 136.32 48.59 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.436 ' HB3' ' CG ' ' A' ' 19' ' ' GLN . 57.3 p -119.0 165.46 14.08 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.7 mt -80.99 -28.59 35.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.084 0.469 . . . . 0.0 109.806 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 p -63.87 -20.84 66.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.086 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -81.38 -44.3 17.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 122.016 0.913 . . . . 0.0 108.572 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.471 HD23 HG13 ' A' ' 38' ' ' VAL . 2.7 tp -80.26 15.86 1.45 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.798 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.575 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 47.3 tttp -69.41 -14.29 62.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.905 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.14 10.73 65.01 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.324 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 3.4 mttm -144.97 177.9 8.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.08 0.467 . . . . 0.0 110.389 177.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.636 HG23 ' HD1' ' A' ' 69' ' ' PHE . 14.7 m -92.07 125.84 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.515 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 38.7 t -107.23 135.71 44.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 112.257 -165.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.612 HD11 HG23 ' A' ' 117' ' ' VAL . 2.0 tm? -96.38 120.22 36.3 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.478 -0.783 . . . . 0.0 108.961 170.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.1 mm -93.95 105.09 16.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 175.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.573 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 31.0 t0 -108.69 135.4 49.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 0.0 111.003 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.73 ' HB3' HD21 ' A' ' 114' ' ' LEU . 70.3 m-85 -123.4 115.44 21.62 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.288 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.1 t -155.95 174.13 15.78 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.736 0.303 . . . . 0.0 110.692 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.579 ' HB ' ' OD2' ' A' ' 77' ' ' ASP . 2.0 m -116.44 144.83 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.361 176.228 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.607 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 15.1 m-85 -102.24 81.03 2.03 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.6 . . . . 0.0 110.72 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.549 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 0.8 OUTLIER 177.9 21.68 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.502 -1.681 . . . . 0.0 107.895 178.617 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -141.34 129.47 22.12 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.592 -163.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.85 78.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.039 -173.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -64.28 -21.24 66.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.011 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -74.64 -27.68 60.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.331 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.57 -51.46 35.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 110.894 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.36 -34.01 77.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.252 0.548 . . . . 0.0 110.44 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.403 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 68.3 t60 -67.45 -35.86 80.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.271 178.153 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -66.95 -37.3 84.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.608 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.6 tt -64.81 -42.04 95.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.361 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.48 85.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.301 0.572 . . . . 0.0 110.333 177.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -66.37 -41.33 89.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.69 176.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.437 ' HA ' ' HZ3' ' A' ' 92' ' ' TRP . 17.0 tpt180 -58.67 -31.94 68.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.102 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.83 -55.88 6.76 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.813 1.292 . . . . 0.0 107.728 -173.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.8 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -54.51 -31.74 56.67 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 112.124 -2.307 . . . . 0.0 111.388 177.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -76.72 -43.39 37.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.037 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -61.63 -22.05 64.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.323 0.582 . . . . 0.0 110.591 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -85.38 -61.62 1.72 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.546 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.569 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 95.7 m-85 -108.23 -8.79 15.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -165.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.489 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -65.97 -30.41 70.96 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 121.984 -0.447 . . . . 0.0 111.594 -176.222 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.8 m -68.24 -18.37 64.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.966 0.413 . . . . 0.0 111.038 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.569 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.4 mp0 -91.1 -61.97 1.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.425 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -177.4 38.88 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.876 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.636 ' HD1' HG23 ' A' ' 37' ' ' VAL . 73.5 t80 -113.17 145.67 40.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.607 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 9.3 tp10 -145.06 147.03 32.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 179.017 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.575 HD12 ' CE3' ' A' ' 92' ' ' TRP . 59.1 mt -111.79 131.18 63.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.982 0.42 . . . . 0.0 110.297 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.505 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.5 t80 -114.87 101.37 8.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.203 177.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 18.4 mt-30 -92.96 136.19 33.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.873 -177.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 56.4 mt -117.59 113.2 41.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.144 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 43' ' ' THR . 9.3 m -91.09 119.04 30.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.362 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.3 mt -100.97 15.23 29.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.409 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.607 ' HB2' ' H ' ' A' ' 45' ' ' TYR . 4.7 t70 -71.85 166.98 20.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.494 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.95 -18.5 46.92 Favored Glycine 0 N--CA 1.441 -1.017 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.584 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -111.19 114.71 28.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.305 0.574 . . . . 0.0 110.951 -178.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.573 ' HB3' ' NH1' ' A' ' 96' ' ' ARG . 11.0 pt-20 -80.15 -20.65 44.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.362 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -46.14 81.17 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.565 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -70.2 -34.65 73.19 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.543 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 12.5 t90 -59.86 -59.96 4.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.939 173.005 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -63.25 -40.42 97.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.275 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 59.8 m -68.31 -34.09 75.51 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.406 -178.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -23.36 29.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.062 0.458 . . . . 0.0 110.365 178.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.563 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -81.38 -18.22 46.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.405 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -53.69 -44.58 69.88 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 111.321 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -91.06 16.45 9.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.851 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.563 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 17.7 mt -86.63 139.09 33.37 Favored Pre-proline 0 N--CA 1.452 -0.374 0 CA-C-O 121.439 0.638 . . . . 0.0 111.895 -179.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.719 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 73.6 Cg_endo -79.13 -30.78 2.51 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.818 3.012 . . . . 0.0 113.485 -176.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.719 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.2 p90 -105.28 -163.26 0.93 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.124 -173.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.64 127.39 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -177.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.8 t -129.67 115.91 18.05 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.6 m -121.95 177.96 3.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.5 -176.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' A' ' 80' ' ' GLU . 32.5 ttp180 -129.93 139.14 51.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.571 0.224 . . . . 0.0 110.593 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.527 ' HA ' HD22 ' A' ' 20' ' ' LEU . 18.4 t70 -83.32 151.07 25.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.942 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.22 -25.29 34.3 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -104.83 -12.78 16.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -173.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.73 -87.49 0.17 Allowed Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.972 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -107.22 -9.98 15.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.006 0.431 . . . . 0.0 110.973 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -103.01 22.62 13.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.114 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.435 ' HB2' HG13 ' A' ' 106' ' ' ILE . 2.2 m -69.25 133.63 48.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.067 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.547 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 14.5 m -57.1 -33.35 67.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.311 176.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -56.35 -48.07 77.54 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.393 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.435 HG13 ' HB2' ' A' ' 103' ' ' SER . 41.9 mt -55.53 -37.42 45.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.666 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 32.8 t -77.92 -22.18 50.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.857 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.9 mt -80.3 -30.65 38.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.469 -177.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.477 ' OH ' HD11 ' A' ' 18' ' ' ILE . 82.7 m-85 -85.46 -19.92 30.52 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.033 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.434 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--N 1.333 -0.152 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -162.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.73 HD21 ' HB3' ' A' ' 42' ' ' PHE . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.29 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.435 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 3.8 Cg_exo -74.74 158.3 99.0 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 124.039 -1.234 . . . . 0.0 112.015 0.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 42' ' ' PHE . 13.6 m -125.86 155.03 41.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.037 0.446 . . . . 0.0 111.375 -173.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.612 HG23 HD11 ' A' ' 39' ' ' LEU . 5.5 p -144.08 143.48 23.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.31 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.598 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 75.9 m-85 -136.07 162.37 33.08 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.81 HD13 HD11 ' A' ' 136' ' ' LEU . 27.3 tp -111.06 143.66 41.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.515 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 53.5 t -133.84 126.6 51.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.532 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.692 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.5 p30 -83.29 167.97 17.12 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 49.2 ptt85 -63.97 1.57 0.65 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -168.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -98.5 7.06 46.64 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.575 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 48.5 t30 60.99 57.33 2.58 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.845 -170.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.692 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 39.8 mt-10 -129.27 145.27 51.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.355 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.04 110.93 4.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.277 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.406 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 7.7 m -80.51 -47.6 14.01 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.693 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.21 165.81 10.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.212 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.619 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 12.1 mpt_? -92.2 162.09 14.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 175.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.06 -44.82 92.91 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 121.485 -0.388 . . . . 0.0 112.845 -176.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.639 ' CD ' ' H ' ' A' ' 131' ' ' GLU . 0.2 OUTLIER -68.88 -23.07 64.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.155 0.502 . . . . 0.0 110.481 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -92.68 -1.87 56.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.95 -176.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.63 HG21 HD13 ' A' ' 136' ' ' LEU . 96.5 mt -99.54 99.85 9.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.558 0.694 . . . . 0.0 110.302 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.424 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 13.1 ptmm? -60.51 -36.38 78.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.065 176.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.424 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 23.5 t70 -166.0 116.75 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.353 -176.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.81 HD11 HD13 ' A' ' 119' ' ' LEU . 1.8 tp -75.96 -26.66 57.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.57 -175.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -54.89 -53.43 55.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.719 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -58.53 -51.1 71.31 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.029 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.639 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.66 -54.54 42.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.905 -173.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.8 HD12 HD12 ' A' ' 60' ' ' LEU . 38.5 mt -63.33 -35.23 71.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.796 0.331 . . . . 0.0 111.008 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -62.39 -49.8 74.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.006 0.431 . . . . 0.0 110.462 178.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.93 -23.73 63.26 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.5 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.639 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 78.4 mt -66.85 -40.26 87.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.104 0.478 . . . . 0.0 110.103 173.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 96.7 mt . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.823 177.73 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.6 tp . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 120.921 0.391 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.474 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -100.81 103.68 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.49 108.52 2.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.335 0.588 . . . . 0.0 110.521 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 29' ' ' SER . 19.4 mm -87.15 124.2 40.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.645 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.575 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 11.0 mt-30 -120.86 100.43 7.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.89 0.376 . . . . 0.0 111.149 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.3 mt -142.03 153.88 44.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.225 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 92.6 mttt -79.81 144.54 33.44 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.244 0.545 . . . . 0.0 110.528 178.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.582 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 3.3 p-10 -90.55 -169.84 2.53 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.04 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.498 ' CD2' ' HA ' ' A' ' 88' ' ' ASP . 37.9 tp -59.0 -36.4 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.42 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -69.71 -24.59 63.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.166 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.63 15.22 21.41 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.218 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.543 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 26.0 m120 -99.51 122.52 42.71 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 17.0 m -66.72 106.87 1.96 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 172.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.575 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -86.82 142.43 28.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.082 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.54 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 73.8 p -121.72 156.95 32.01 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 172.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.447 HD12 ' O ' ' A' ' 16' ' ' ILE . 53.7 mt -74.38 -27.02 60.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.091 0.472 . . . . 0.0 109.868 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.8 p -67.81 -14.79 63.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.187 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -91.28 -40.25 11.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 0.0 109.446 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.563 HD23 HG13 ' A' ' 38' ' ' VAL . 3.4 tp -77.11 3.65 12.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.346 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 36.9 ttpt -61.22 -18.42 58.23 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.436 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -71.73 -12.39 74.22 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.588 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -123.7 -177.89 3.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.98 0.419 . . . . 0.0 110.103 177.276 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.684 HG23 ' HD1' ' A' ' 69' ' ' PHE . 5.5 m -93.71 126.75 46.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 167.017 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.566 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 22.1 t -102.16 129.45 53.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.255 0.55 . . . . 0.0 112.132 -165.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.727 HD12 ' HZ ' ' A' ' 69' ' ' PHE . 6.2 tt -92.87 110.06 21.51 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 171.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.639 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 35.0 mm -84.74 106.15 14.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.99 0.424 . . . . 0.0 110.31 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.651 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 5.4 t70 -104.14 134.61 47.11 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.123 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.4 ' HB3' HD11 ' A' ' 114' ' ' LEU . 17.0 m-85 -119.54 108.91 15.09 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.021 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.503 ' O ' ' HA ' ' A' ' 75' ' ' SER . 6.4 t -143.85 -175.45 4.59 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.219 0.533 . . . . 0.0 110.75 -174.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.766 HG13 ' HB2' ' A' ' 47' ' ' ASN . 2.5 p -145.12 128.15 10.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.653 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.516 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 30.1 m-85 -78.12 79.4 4.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.853 0.835 . . . . 0.0 109.807 178.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 176.1 -27.56 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 113.543 -1.662 . . . . 0.0 109.687 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.766 ' HB2' HG13 ' A' ' 44' ' ' VAL . 41.7 t-20 -73.21 135.33 44.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.729 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.82 68.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.345 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.21 -24.43 63.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.8 m -63.29 -28.98 70.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -176.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.38 -59.62 4.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.833 0.349 . . . . 0.0 111.256 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.05 -32.72 73.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.922 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.428 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 67.8 t60 -62.46 -42.96 99.84 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.022 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -70.04 -21.59 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.662 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.3 -44.02 65.96 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 177.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.3 75.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.36 0.6 . . . . 0.0 110.091 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.466 ' HB3' HD13 ' A' ' 71' ' ' ILE . 82.9 mt -65.96 -40.61 91.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.837 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.526 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 28.5 tpt180 -60.68 -28.82 68.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.22 177.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.55 -56.97 4.14 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 122.528 1.156 . . . . 0.0 108.148 -171.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.708 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -57.91 -32.48 67.79 Favored 'General case' 0 N--CA 1.425 -1.68 0 CA-C-N 112.348 -2.205 . . . . 0.0 111.515 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -75.65 -44.43 42.6 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.293 0.568 . . . . 0.0 109.647 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 15.1 t30 -59.75 -26.11 65.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.866 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -83.55 -61.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.701 -1.136 . . . . 0.0 112.434 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -105.69 -7.2 18.58 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -163.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.582 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.17 -35.37 69.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.12 0.418 . . . . 0.0 111.93 -177.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 m -66.21 -12.44 56.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.183 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.445 ' HB2' HD13 ' A' ' 144' ' ' LEU . 50.3 mt-30 -106.27 17.58 23.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.173 -178.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.02 46.39 3.11 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.113 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.727 ' HZ ' HD12 ' A' ' 39' ' ' LEU . 46.9 t80 -120.8 136.24 54.95 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -142.59 142.79 32.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.193 0.52 . . . . 0.0 110.277 -176.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.482 HG23 HD22 ' A' ' 39' ' ' LEU . 60.0 mt -102.52 132.66 48.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.3 -176.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.506 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.7 t80 -115.7 101.2 8.62 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.676 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.651 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 2.0 mt-30 -90.72 128.08 36.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.469 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.3 mt -109.01 109.36 28.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.706 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 43' ' ' THR . 1.1 m -93.94 142.1 27.76 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.454 -178.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 mt -115.73 27.79 9.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.835 0.35 . . . . 0.0 110.96 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.4 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.7 p30 -84.1 178.48 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.871 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -137.73 35.43 2.05 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.983 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -138.36 134.14 33.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.984 0.421 . . . . 0.0 110.363 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -77.45 -31.42 53.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 51.0 m80 -68.79 -51.88 36.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.439 -167.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -71.49 -44.55 64.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.516 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 56.7 t90 -59.68 -49.6 77.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.491 -179.221 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 51.9 tttm -61.33 -61.72 2.34 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -177.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.8 m -55.44 -38.77 69.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.037 -173.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.484 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.4 m -74.48 -39.51 62.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.421 -177.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.407 ' HA ' HD12 ' A' ' 90' ' ' LEU . . . -87.44 -20.87 26.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.062 0.458 . . . . 0.0 111.458 -174.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.537 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -60.0 -35.54 75.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.532 -176.905 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -96.26 8.52 43.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.732 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 86' ' ' SER . 25.6 mt -93.82 149.05 36.4 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-O 121.249 0.547 . . . . 0.0 111.55 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.581 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 98.6 Cg_endo -74.32 -56.96 0.07 OUTLIER 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.59 2.86 . . . . 0.0 113.86 -175.632 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.581 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.5 p90 -83.37 -166.5 1.39 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.946 -169.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -87.52 133.32 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.813 -171.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 83.3 m -133.14 110.66 10.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.904 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.582 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 16.0 m -116.34 163.34 13.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.928 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -129.98 144.04 51.12 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.445 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -76.48 162.03 28.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.103 178.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.54 -34.95 65.45 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -177.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.425 ' HA ' HD22 ' A' ' 99' ' ' ASN . 1.0 OUTLIER -122.43 -11.27 8.34 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.751 -174.965 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.76 -113.72 3.82 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.252 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.31 5.58 4.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.851 0.358 . . . . 0.0 111.892 -174.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -110.29 9.51 23.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.973 0.416 . . . . 0.0 110.206 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 14.4 t -63.83 130.2 43.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.127 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.7 m -58.49 -28.95 65.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.699 -177.046 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.49 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 80.3 m-85 -61.54 -36.9 81.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.007 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.08 -34.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.603 -175.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 41.2 m -80.09 -18.6 49.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.921 0.391 . . . . 0.0 111.115 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.4 mt -81.0 -33.44 33.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.07 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.49 ' HE2' ' HB3' ' A' ' 105' ' ' TYR . 78.3 m-85 -83.76 -9.43 58.81 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.81 178.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 CA--C 1.516 -0.343 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 -168.261 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.606 ' CG ' ' HA ' ' A' ' 115' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.413 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.606 ' HA ' ' CG ' ' A' ' 114' ' ' LEU . 7.5 Cg_exo -71.24 162.83 87.21 Favored 'Cis proline' 0 C--N 1.352 0.722 0 C-N-CA 124.64 -0.983 . . . . 0.0 113.409 1.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 49.2 m -143.82 173.85 11.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.386 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.83 156.41 17.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.449 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.639 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 78.3 m-85 -146.36 158.68 43.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.772 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 17.7 tp -112.57 145.31 40.56 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.924 -177.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.599 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 34.6 t -138.5 126.12 28.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.645 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -80.92 168.26 18.93 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -76.72 16.3 0.53 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -172.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -105.8 10.59 32.58 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 167.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.451 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 40.0 t30 56.48 63.75 1.88 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.908 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.599 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 46.1 mt-10 -127.46 140.87 51.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.673 176.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.5 tt -69.68 107.75 3.58 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.772 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 52.6 m -74.53 -52.98 10.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.335 -177.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -165.56 164.5 19.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.116 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.583 ' O ' HG13 ' A' ' 133' ' ' ILE . 99.4 mtt180 -102.06 151.62 21.93 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.441 ' O ' ' HB2' ' A' ' 131' ' ' GLU . . . -54.83 155.62 8.39 Favored Glycine 0 N--CA 1.452 -0.237 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 173.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 130' ' ' GLY . 26.2 mm-40 71.84 -40.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.119 0.568 . . . . 0.0 110.742 -172.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.441 ' O ' ' HG3' ' A' ' 134' ' ' LYS . 4.1 m-20 -80.39 -29.86 37.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.954 0.407 . . . . 0.0 110.026 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 129' ' ' ARG . 51.3 mt -59.52 -44.32 92.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.807 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 132' ' ' ASN . 50.9 mttp 74.29 -58.47 0.58 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.428 0.691 . . . . 0.0 110.851 179.295 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -139.77 110.47 6.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.541 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.888 HD13 HD11 ' A' ' 140' ' ' ILE . 0.3 OUTLIER -77.11 -28.01 54.25 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.11 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.412 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.0 t70 -57.21 -52.27 65.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.693 0.282 . . . . 0.0 111.012 -172.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.46 -34.97 79.13 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.015 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.591 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -63.26 -52.36 62.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.694 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.888 HD11 HD13 ' A' ' 136' ' ' LEU . 30.1 mt -65.15 -40.04 87.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -62.75 -44.22 96.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.845 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -72.02 -19.7 61.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 79.1 mt -68.48 -39.76 81.22 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.637 0.732 . . . . 0.0 109.349 171.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.445 HD13 ' HB2' ' A' ' 67' ' ' GLN . 88.4 mt . . . . . 0 C--N 1.321 -0.668 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.918 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.7 tp . . . . . 0 N--CA 1.443 -0.823 0 CA-C-O 121.286 0.565 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.477 ' O ' HD12 ' A' ' 30' ' ' LEU . 95.0 mt -87.6 101.94 11.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.885 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -68.73 107.87 3.18 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.803 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 29' ' ' SER . 23.4 mm -87.93 113.8 25.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.222 -178.036 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.536 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 80.3 mt-30 -108.78 100.26 9.51 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.377 0.608 . . . . 0.0 110.864 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.641 ' HB2' HG11 ' A' ' 95' ' ' VAL . 45.5 mt -137.99 159.98 40.58 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 41.6 mttp -89.01 135.4 33.57 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.154 0.502 . . . . 0.0 111.532 -177.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.562 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 21.5 p30 -81.79 -167.26 1.45 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.587 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.705 HD21 ' HB3' ' A' ' 87' ' ' ALA . 91.1 mt -50.33 -35.98 30.08 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.508 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -83.86 -6.54 59.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.718 -176.502 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.85 12.76 70.96 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -173.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -88.06 112.96 23.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.262 -0.469 . . . . 0.0 110.181 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.587 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.0 m -61.88 111.38 1.87 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.154 0.502 . . . . 0.0 111.144 177.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.481 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 14.4 mmt180 -90.64 142.52 27.67 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.55 173.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.536 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 79.6 p -119.22 165.6 14.03 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 171.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.506 HD22 HG11 ' A' ' 38' ' ' VAL . 62.8 mt -79.61 -24.93 41.63 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 p -68.09 -18.26 64.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.938 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -83.3 -41.36 18.37 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.66 0.743 . . . . 0.0 109.449 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.727 HD23 HG13 ' A' ' 38' ' ' VAL . 4.6 tp -76.1 -7.19 54.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.727 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.603 ' NZ ' ' HB3' ' A' ' 34' ' ' LYS . 1.1 ttpm? -61.17 99.83 0.11 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.128 175.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.88 -30.76 0.21 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -174.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.608 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 86.4 mttt -113.2 177.5 4.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 167.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.812 HG23 ' HD1' ' A' ' 69' ' ' PHE . 13.0 m -82.35 130.72 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.727 HG13 HD23 ' A' ' 33' ' ' LEU . 43.6 t -101.72 124.03 55.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.178 0.514 . . . . 0.0 111.751 -167.308 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.552 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.4 tp -94.28 112.6 24.4 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.765 175.054 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.63 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.4 mm -85.2 105.27 13.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.514 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 29.2 t70 -107.8 110.83 22.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.744 -178.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.44 ' HB3' HD13 ' A' ' 114' ' ' LEU . 36.1 m-85 -95.05 105.18 17.08 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.539 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.6 t -137.56 -175.84 4.2 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.402 0.62 . . . . 0.0 111.563 -170.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.559 HG23 ' HB3' ' A' ' 77' ' ' ASP . 0.2 OUTLIER -143.0 122.39 8.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.782 178.654 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.706 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 49.4 m-85 -81.27 79.97 7.8 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 9.7 t30 174.79 -30.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.846 175.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.498 ' HB2' HG13 ' A' ' 44' ' ' VAL . 38.4 t-20 -66.82 134.53 52.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.507 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.27 -30.87 70.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.305 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.8 tpt -64.29 -30.1 71.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.906 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 m -68.46 -28.27 66.9 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.356 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.91 -53.75 45.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.864 0.364 . . . . 0.0 110.929 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.78 63.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.198 0.523 . . . . 0.0 110.604 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.493 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.1 t60 -65.3 -44.23 88.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.041 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.469 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.6 m-20 -66.3 -27.15 67.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.647 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.44 -55.11 34.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.262 0.553 . . . . 0.0 109.839 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.57 -32.92 73.03 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.845 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.1 mt -64.45 -39.48 93.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.864 176.083 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -62.35 -33.34 74.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.492 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.542 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 2.2 tt0 -71.77 -52.61 16.79 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.815 HD12 HD12 ' A' ' 140' ' ' ILE . 1.5 mm? -51.69 -34.97 40.82 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 112.952 -1.931 . . . . 0.0 111.577 177.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -75.9 -41.52 51.71 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.189 0.518 . . . . 0.0 110.065 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -65.28 -21.43 66.72 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.832 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.611 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 36.3 mttm -80.99 -61.73 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.602 -178.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.428 ' HE1' ' HG3' ' A' ' 141' ' ' LYS . 71.1 m-85 -111.21 -10.91 14.27 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -163.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.597 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.88 -31.31 71.58 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.307 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.5 m -64.18 -24.88 67.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.978 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -96.12 -6.93 37.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.027 0.442 . . . . 0.0 110.67 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.426 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 117.27 64.41 0.33 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.638 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.812 ' HD1' HG23 ' A' ' 37' ' ' VAL . 34.4 t80 -134.44 141.93 46.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.664 ' HG2' HD11 ' A' ' 33' ' ' LEU . 7.9 tp10 -140.24 148.6 41.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.351 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.569 ' HB ' ' CG ' ' A' ' 92' ' ' TRP . 48.0 mt -112.51 124.93 69.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.018 0.437 . . . . 0.0 109.963 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.581 ' CE1' HG21 ' A' ' 95' ' ' VAL . 88.2 t80 -109.86 100.43 9.41 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.514 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.4 mt-30 -92.2 135.43 34.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.092 0.472 . . . . 0.0 111.29 -178.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 68.2 mt -117.95 110.77 31.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.458 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.73 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 34.6 p -85.35 136.95 33.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.689 0.28 . . . . 0.0 111.114 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.462 HD22 ' H ' ' A' ' 101' ' ' ALA . 50.8 mt -105.39 13.74 29.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.812 0.339 . . . . 0.0 110.829 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.73 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 2.2 p-10 -86.47 163.04 17.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.969 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -98.09 -29.06 7.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.768 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.477 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 13.5 t0 -76.45 110.19 10.79 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.397 0.618 . . . . 0.0 110.669 -178.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.604 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 32.1 tt0 -70.93 -19.94 62.52 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.334 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' HIS . . . . . 0.477 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.0 OUTLIER -71.53 -45.04 63.48 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.835 -175.756 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -71.14 -44.95 64.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.977 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.517 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 39.2 t90 -55.9 -42.84 76.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.354 172.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.604 ' HB2' ' O ' ' A' ' 80' ' ' GLU . 11.5 tppt? -60.91 -57.47 12.52 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.96 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 p -65.14 -41.42 94.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.296 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.401 ' HB2' ' HD2' ' A' ' 45' ' ' TYR . 38.2 m -67.69 -37.46 82.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.424 -178.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.705 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -86.58 -17.74 33.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.604 -177.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -50.18 -35.04 24.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.039 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -109.76 16.04 22.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.536 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 87' ' ' ALA . 27.8 mt -89.63 146.88 36.53 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.144 0.497 . . . . 0.0 111.525 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.709 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 93.1 Cg_endo -79.96 -40.49 0.23 Allowed 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 123.694 2.929 . . . . 0.0 114.027 -176.252 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.709 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.0 p90 -96.15 -168.09 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.783 0.325 . . . . 0.0 111.627 -170.449 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.411 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 24.8 t -81.61 120.29 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 121.148 0.499 . . . . 0.0 110.528 -171.314 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 35.0 m -116.3 106.54 13.77 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.956 -176.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.641 HG11 ' HB2' ' A' ' 20' ' ' LEU . 7.9 t -121.29 159.69 23.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.463 -172.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.567 HH12 ' HB2' ' A' ' 80' ' ' GLU . 54.0 ttp180 -120.34 141.78 49.73 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.763 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.527 ' HA ' HD13 ' A' ' 20' ' ' LEU . 30.4 t70 -73.2 160.53 31.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.321 177.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.79 -28.43 33.21 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -174.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.484 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 33.4 t30 -122.49 -12.69 8.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 112.46 -172.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.55 84.72 0.23 Allowed Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.651 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.462 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 75.19 -32.78 0.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.46 0.704 . . . . 0.0 111.926 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.484 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 52.3 m-85 -86.28 37.04 0.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.066 0.46 . . . . 0.0 110.016 176.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.432 ' HB3' HG13 ' A' ' 106' ' ' ILE . 23.1 t -87.22 136.73 32.82 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.346 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.8 m -61.83 -29.25 70.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.06 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -64.79 -41.42 95.84 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.843 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.432 HG13 ' HB3' ' A' ' 103' ' ' SER . 71.7 mt -56.81 -38.78 60.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.165 -178.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 36.1 t -68.91 -28.62 66.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.758 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.43 -26.68 61.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.94 0.4 . . . . 0.0 110.56 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -83.85 -1.55 54.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.751 0 CA-C-O 121.805 0.812 . . . . 0.0 110.198 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.621 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 53.8 mt . . . . . 0 CA--C 1.533 0.294 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.621 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.18 158.89 91.82 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.614 0.898 . . . . 0.0 113.582 1.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.1 m -155.22 164.3 38.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.012 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.43 154.05 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.63 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.1 m-85 -132.35 161.86 32.52 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.692 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.4 tp -110.85 131.67 54.85 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.946 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 23.0 t -129.31 127.4 65.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 174.082 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.475 ' HB3' HD22 ' A' ' 143' ' ' LEU . 8.0 p30 -83.78 170.76 13.82 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.029 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -60.81 -12.67 11.54 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 124.272 0.983 . . . . 0.0 113.544 -164.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -95.71 13.46 26.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 34.0 t30 61.01 54.78 3.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.841 -174.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.474 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.9 mm-40 -122.25 137.36 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.54 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 126' ' ' LEU . 10.0 mt -68.49 112.27 5.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 0.0 110.437 175.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.692 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 24.4 m -81.37 -55.02 4.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.005 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -168.33 172.39 8.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.46 -175.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.677 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -93.94 161.88 14.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 108.96 176.001 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.507 ' HA2' HD12 ' A' ' 133' ' ' ILE . . . -48.05 -48.99 24.91 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 114.7 0.64 . . . . 0.0 114.7 -172.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.85 -26.87 59.99 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 117.028 0.414 . . . . 0.0 110.739 -176.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.429 ' ND2' HH21 ' A' ' 129' ' ' ARG . 4.5 m-20 -72.35 -34.18 67.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.877 175.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.888 HG21 ' HG ' ' A' ' 136' ' ' LEU . 49.1 mt -69.46 -40.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.56 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.587 ' HG3' ' C ' ' A' ' 133' ' ' ILE . 0.0 OUTLIER 48.45 -86.51 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.287 0.992 . . . . 0.0 112.023 -173.273 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -88.43 84.78 6.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.093 -176.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.888 ' HG ' HG21 ' A' ' 133' ' ' ILE . 4.6 mp -60.6 -32.53 71.65 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.719 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -52.85 -56.09 18.36 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.812 0.339 . . . . 0.0 110.365 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.33 -41.64 93.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.777 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -58.09 -54.88 42.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.614 -177.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.815 HD12 HD12 ' A' ' 60' ' ' LEU . 35.8 mt -65.35 -35.23 74.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.862 0.363 . . . . 0.0 110.948 -177.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.428 ' HG3' ' HE1' ' A' ' 64' ' ' TYR . 3.5 ttmp? -60.15 -42.52 95.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.156 0.503 . . . . 0.0 109.991 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -82.84 -18.4 40.54 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.861 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 55.7 mt -62.2 -38.42 89.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.419 0.628 . . . . 0.0 109.544 170.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 44.5 mt . . . . . 0 N--CA 1.447 -0.583 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.158 179.423 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.502 HD13 HG11 ' A' ' 120' ' ' VAL . 4.9 tp . . . . . 0 N--CA 1.447 -0.614 0 CA-C-O 121.057 0.456 . . . . 0.0 110.991 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.416 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.1 mp -94.39 102.73 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 168.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.92 132.47 44.4 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.403 ' H ' ' HG ' ' A' ' 30' ' ' LEU . 8.4 mt -113.61 105.54 18.94 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.25 -176.308 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.0 OUTLIER -93.88 101.44 13.52 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.267 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.507 ' HB2' HG11 ' A' ' 95' ' ' VAL . 78.4 mt -137.54 155.66 48.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.4 mtmt -89.0 137.99 31.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.495 0.664 . . . . 0.0 111.425 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.619 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -87.64 -169.89 2.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.87 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.677 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 36.5 tp -48.33 -39.52 22.27 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.603 0.761 . . . . 0.0 112.716 -178.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.9 mtmm -74.98 -13.6 60.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.999 0.428 . . . . 0.0 111.738 -177.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.63 17.25 55.17 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 -175.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.445 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 4.0 m-20 -99.56 127.56 45.64 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.5 m -67.97 113.78 5.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.491 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 16.5 mmm180 -92.45 142.29 27.58 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.441 ' O ' ' HB3' ' A' ' 32' ' ' ASP . 2.0 m -134.31 163.66 29.15 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 174.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.487 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 65.4 mt -80.08 -32.88 39.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.553 -172.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.7 p -64.21 -14.32 54.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.018 0.437 . . . . 0.0 111.116 173.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t0 -82.6 -45.07 15.03 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -76.35 0.13 20.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.473 -1.24 . . . . 0.0 110.659 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.5 ' HA ' HD22 ' A' ' 124' ' ' ASN . 7.4 ttpm? -58.26 134.58 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.736 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.69 -29.88 5.5 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -174.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.581 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 61.4 mttm -112.38 166.15 11.55 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.761 HG23 ' HD1' ' A' ' 69' ' ' PHE . 8.5 m -84.27 124.44 39.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.626 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 99.4 t -102.06 132.03 48.86 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 121.641 0.734 . . . . 0.0 111.045 -169.424 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.645 HD22 HG23 ' A' ' 71' ' ' ILE . 6.4 tt -94.38 104.27 16.25 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 172.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.441 HG13 ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -88.46 104.34 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.281 178.339 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.571 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.2 t70 -103.26 142.02 34.9 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.065 -175.111 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -124.3 95.93 4.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 173.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.442 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.7 t -123.7 -175.71 3.28 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.296 -174.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.561 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -137.78 111.51 8.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.08 0.467 . . . . 0.0 110.628 178.85 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.492 ' CD1' ' HB2' ' A' ' 75' ' ' SER . 41.7 m-85 -72.55 79.18 1.06 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 51.4 t30 172.51 -25.59 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.224 -177.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.561 ' HB2' HG13 ' A' ' 44' ' ' VAL . 5.6 t-20 -82.29 150.15 27.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.643 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.02 -30.95 62.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -71.77 -20.17 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.75 -176.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.0 m -63.97 -24.69 67.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.623 0.249 . . . . 0.0 111.329 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.05 -50.23 74.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.802 0.334 . . . . 0.0 111.269 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.61 -31.94 60.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.103 0.478 . . . . 0.0 110.814 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.41 ' HE2' ' CG ' ' A' ' 41' ' ' ASP . 86.3 t60 -63.72 -45.11 91.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.715 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.409 HD21 ' N ' ' A' ' 54' ' ' ASN . 0.9 OUTLIER -71.71 -18.78 62.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.836 -176.033 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -73.85 -44.31 55.92 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.95 -37.77 77.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.395 0.616 . . . . 0.0 109.882 175.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.87 -40.31 91.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.926 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.478 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 13.1 tpt180 -56.14 -35.96 67.72 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.958 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.55 -50.96 11.49 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -172.168 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.912 HD12 HD12 ' A' ' 140' ' ' ILE . 1.9 mm? -55.97 -31.34 62.9 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 113.262 -1.79 . . . . 0.0 111.441 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.416 ' HD1' HG13 ' A' ' 71' ' ' ILE . 23.9 t80 -82.83 -44.03 15.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.387 0.613 . . . . 0.0 109.876 -178.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 29.1 t30 -60.65 -24.82 65.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.116 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -85.95 -60.67 1.95 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.815 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.57 -12.51 16.4 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -164.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.552 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.41 -31.77 70.7 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -174.051 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 m -60.35 -28.73 68.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.168 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.555 ' HG3' HD13 ' A' ' 144' ' ' LEU . 9.2 pt20 -108.68 29.77 7.12 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 99.02 48.62 1.71 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.067 -1.063 . . . . 0.0 112.852 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.761 ' HD1' HG23 ' A' ' 37' ' ' VAL . 37.3 t80 -132.23 140.5 48.7 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.426 ' OE1' HG23 ' A' ' 93' ' ' VAL . 0.3 OUTLIER -140.62 151.2 44.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.493 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.645 HG23 HD22 ' A' ' 39' ' ' LEU . 65.2 mt -114.24 111.0 34.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.714 0.769 . . . . 0.0 110.394 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.537 ' CE1' HG21 ' A' ' 95' ' ' VAL . 91.5 t80 -96.56 99.17 10.82 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.571 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 52.1 tt0 -100.96 114.35 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.349 -171.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.413 HD11 ' HE2' ' A' ' 72' ' ' TYR . 50.0 mt -96.71 124.6 49.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.218 177.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.492 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 27.9 t -96.93 137.95 35.23 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.904 0.383 . . . . 0.0 110.472 177.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 31.0 mt -112.08 34.32 4.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.653 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.421 ' OD2' ' HD3' ' A' ' 96' ' ' ARG . 3.6 p30 -82.92 -176.16 6.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.449 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.7 35.98 1.88 Allowed Glycine 0 N--CA 1.444 -0.773 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.45 176.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -145.35 115.83 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.359 0.599 . . . . 0.0 110.995 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.505 ' HA ' HH12 ' A' ' 96' ' ' ARG . 4.9 tp10 -64.65 -36.0 82.84 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.096 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -61.51 -56.38 20.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.585 -170.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -68.55 -41.05 80.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.76 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.677 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 53.2 t90 -60.81 -55.12 36.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.545 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.412 ' HE2' HD12 ' A' ' 23' ' ' LEU . 2.6 ttmt -57.32 -46.93 82.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.899 0.381 . . . . 0.0 111.362 -176.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 21.3 m -70.2 -42.47 72.3 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.804 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.6 t -75.43 -42.38 53.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.05 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.601 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -64.59 -32.13 73.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.863 0.363 . . . . 0.0 110.99 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.53 -27.84 68.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.413 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.61 -1.99 42.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.528 -176.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.476 HD12 ' OH ' ' A' ' 45' ' ' TYR . 26.8 mt -96.7 148.59 34.66 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 121.171 0.51 . . . . 0.0 112.229 -176.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.618 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 89.4 Cg_endo -74.41 -51.79 0.13 Allowed 'Trans proline' 0 N--CA 1.478 0.611 0 C-N-CA 124.128 3.219 . . . . 0.0 114.423 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.618 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -83.57 -178.95 7.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.627 -172.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.426 HG23 ' OE1' ' A' ' 70' ' ' GLU . 99.1 t -70.2 125.19 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 121.294 0.568 . . . . 0.0 111.052 -173.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.601 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 1.8 p -113.97 105.21 12.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.396 -176.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.619 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 1.7 t -115.36 161.51 14.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.379 -172.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.505 HH12 ' HA ' ' A' ' 80' ' ' GLU . 46.9 ttp180 -140.49 140.12 35.25 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.255 170.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -93.94 149.33 21.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.63 175.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.65 -1.75 47.84 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -173.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -110.01 -12.49 14.53 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.106 -0.371 . . . . 0.0 111.702 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.21 -117.1 8.66 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.119 -178.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -91.63 25.15 2.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.86 0.362 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -130.22 17.27 5.52 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.419 178.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.543 ' HB2' HG13 ' A' ' 106' ' ' ILE . 10.5 m -61.96 134.55 56.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.204 -178.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 4.0 m -55.78 -35.22 66.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.012 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -57.08 -47.56 80.72 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.543 HG13 ' HB2' ' A' ' 103' ' ' SER . 68.2 mt -57.93 -37.76 62.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.928 -177.449 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 16.0 m -70.33 -36.19 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.898 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.5 mt -66.01 -34.87 79.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.305 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -71.44 -29.75 65.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.667 0.27 . . . . 0.0 110.853 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -163.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 3.6 mm? . . . . . 0 C--O 1.236 0.355 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.547 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.7 Cg_endo -73.36 153.5 99.17 Favored 'Cis proline' 0 C--N 1.35 0.607 0 C-N-CA 123.811 -1.329 . . . . 0.0 113.163 0.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.431 ' HB2' HD13 ' A' ' 114' ' ' LEU . 30.4 m -151.13 178.57 9.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.383 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.617 HG12 ' HA3' ' A' ' 130' ' ' GLY . 4.3 p -139.36 162.21 27.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.441 ' HB2' HG13 ' A' ' 40' ' ' ILE . 91.6 m-85 -144.27 157.17 44.42 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.871 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.7 tp -112.77 144.92 41.48 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.079 -0.248 . . . . 0.0 110.681 -177.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 126' ' ' LEU . 5.1 m -141.67 140.5 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 120.853 0.359 . . . . 0.0 110.9 169.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.63 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 5.3 p30 -80.49 173.83 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.603 ' HG3' HG13 ' A' ' 37' ' ' VAL . 98.2 mtt180 -52.55 -30.03 28.53 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.147 1.165 . . . . 0.0 114.147 -171.002 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -76.79 4.93 8.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.094 0.474 . . . . 0.0 110.243 177.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.5 HD22 ' HA ' ' A' ' 34' ' ' LYS . 3.2 m-80 58.44 61.95 2.11 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.221 -173.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.63 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 46.1 mt-10 -124.94 132.18 53.32 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.85 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.643 ' HA ' HG12 ' A' ' 120' ' ' VAL . 1.2 tt -58.91 113.39 2.05 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 123.895 0.747 . . . . 0.0 110.504 -174.146 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.871 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.6 m -77.88 -55.29 5.43 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.581 -179.294 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.56 ' HB3' HD11 ' A' ' 133' ' ' ILE . . . -172.71 171.48 4.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.299 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.732 ' HB2' ' ND2' ' A' ' 132' ' ' ASN . 57.9 mtt180 -90.48 144.91 25.33 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.11 -178.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.617 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -64.48 -17.77 62.55 Favored Glycine 0 C--N 1.319 -0.387 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 172.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.622 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 10.9 mt-10 -64.94 -24.71 67.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.099 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.732 ' ND2' ' HB2' ' A' ' 129' ' ' ARG . 4.2 p30 -118.49 -23.14 7.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.562 179.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.56 HD11 ' HB3' ' A' ' 128' ' ' ALA . 70.5 mt -79.41 101.85 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.919 0.39 . . . . 0.0 110.461 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.474 ' H ' ' HG2' ' A' ' 134' ' ' LYS . 11.3 ptmm? -84.76 -32.35 23.47 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -121.61 93.29 3.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.538 ' O ' HG13 ' A' ' 140' ' ' ILE . 5.8 mp -75.85 -25.52 56.29 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.228 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.574 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.1 t70 -49.37 -58.01 5.88 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 123.433 0.458 . . . . 0.0 110.931 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -60.7 -42.98 98.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.813 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -57.81 -53.1 61.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.456 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.912 HD12 HD12 ' A' ' 60' ' ' LEU . 33.7 mt -64.54 -40.56 89.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.889 0.376 . . . . 0.0 110.949 -178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -58.92 -47.28 85.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.436 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -68.41 -20.47 64.67 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.766 -177.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 87.5 mt -72.8 -40.81 65.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.263 0.554 . . . . 0.0 110.239 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.555 HD13 ' HG3' ' A' ' 67' ' ' GLN . 97.6 mt . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.334 -176.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.613 HD11 HD13 ' A' ' 30' ' ' LEU . 4.9 tp . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 121.232 0.539 . . . . 0.0 110.306 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.467 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.4 mp -66.55 120.04 12.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.66 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.66 107.69 4.63 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.057 0.456 . . . . 0.0 110.017 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.678 ' O ' ' HA ' ' A' ' 29' ' ' SER . 12.9 mt -106.18 110.3 30.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.872 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.548 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 95.1 mt-30 -107.47 101.4 10.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.122 0.486 . . . . 0.0 111.33 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.59 ' HB2' HG11 ' A' ' 95' ' ' VAL . 28.4 mt -137.19 157.99 45.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.721 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 47.9 mttm -94.8 158.95 15.27 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.391 0.615 . . . . 0.0 111.675 -175.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -95.44 -169.74 2.03 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.39 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.775 HD11 ' HB1' ' A' ' 87' ' ' ALA . 6.4 mp -52.97 -41.5 64.62 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.6 0.562 . . . . 0.0 111.844 -176.538 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 67.5 mttm -81.3 -16.62 51.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.1 -175.061 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.47 6.88 40.81 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.959 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.415 ' OD1' ' HB2' ' A' ' 24' ' ' LYS . 2.4 m120 -80.99 126.36 31.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.3 m -74.86 112.82 11.47 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.959 0.409 . . . . 0.0 110.637 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HG3' HG13 ' A' ' 93' ' ' VAL . 3.6 mmm-85 -100.49 143.47 30.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.678 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.2 p -127.42 175.93 7.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.278 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.613 HD13 HD11 ' A' ' 15' ' ' ILE . 97.2 mt -78.9 -10.95 59.97 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.632 ' HA ' ' HB2' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -88.46 2.27 53.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.334 169.524 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.476 ' HB2' ' H ' ' A' ' 29' ' ' SER . 29.1 t70 -95.94 -33.51 12.15 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.91 HD13 HG21 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -111.47 18.24 19.33 Favored 'General case' 0 C--O 1.249 1.073 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.762 173.298 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.632 ' HB2' ' HA ' ' A' ' 31' ' ' THR . 56.4 tttp -70.93 66.64 0.38 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.202 179.051 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.41 -23.63 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.032 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.863 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.735 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -137.76 -174.41 3.77 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.95 174.62 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.748 HG22 ' H ' ' A' ' 122' ' ' ARG . 54.6 t -72.17 118.27 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -176.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.91 HG21 HD13 ' A' ' 33' ' ' LEU . 78.0 t -117.55 132.46 67.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-O 122.038 0.923 . . . . 0.0 113.257 -168.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.562 ' HB3' HG23 ' A' ' 71' ' ' ILE . 2.2 tt -81.14 123.49 28.47 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.274 171.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.588 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 5.6 mm -99.42 105.54 17.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 173.507 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.484 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 16.5 t70 -108.55 132.69 53.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.025 0.44 . . . . 0.0 111.582 -175.682 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.639 ' HB3' HD21 ' A' ' 114' ' ' LEU . 62.8 m-85 -121.64 109.82 15.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.529 174.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 t -150.06 176.82 10.45 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.695 HG23 ' HB2' ' A' ' 47' ' ' ASN . 17.8 m -119.59 113.27 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.64 175.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.812 ' CD1' ' HB2' ' A' ' 75' ' ' SER . 33.6 m-85 -67.72 84.77 0.2 Allowed 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.673 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 57.2 t30 174.04 -35.65 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.098 0.951 . . . . 0.0 109.228 -172.185 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.695 ' HB2' HG23 ' A' ' 44' ' ' VAL . 9.4 t-20 -85.07 143.09 29.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.265 -172.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.55 69.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.367 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.8 mtp -65.56 -24.33 67.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.184 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -81.47 -23.87 37.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.562 -176.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.58 -56.9 14.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.844 0.354 . . . . 0.0 110.827 -178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.78 -27.46 65.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.597 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.6 t60 -66.7 -45.64 78.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.614 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.503 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.4 m-20 -67.05 -27.91 67.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.23 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -61.13 -56.22 23.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.133 0.492 . . . . 0.0 109.896 176.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.43 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . -59.43 -33.38 71.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.021 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 96.3 mt -63.34 -40.8 98.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 110.136 176.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.865 HH21 ' HD3' ' A' ' 91' ' ' PRO . 14.5 ttm180 -64.89 -29.94 70.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.048 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -74.01 -51.82 14.69 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.473 ' CD1' ' HB3' ' A' ' 136' ' ' LEU . 22.7 mt -55.71 -35.91 66.6 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 111.742 -2.481 . . . . 0.0 111.336 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -73.02 -48.36 36.93 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.684 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -62.56 -22.35 66.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.637 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -79.32 -57.65 3.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.135 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.466 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 84.7 m-85 -112.6 -8.68 13.81 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -164.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.568 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.48 -43.0 83.74 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -173.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.4 m -67.84 -16.23 64.0 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.755 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.466 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.1 mp0 -93.88 -0.53 55.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 110.736 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.69 50.6 0.52 Allowed Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.498 -0.858 . . . . 0.0 111.814 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.568 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 80.8 t80 -130.45 136.14 48.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.122 0.487 . . . . 0.0 110.749 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.735 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.5 tp10 -135.7 159.94 40.08 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.461 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 39' ' ' LEU . 48.5 mt -131.0 130.15 63.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.007 0.432 . . . . 0.0 110.231 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.842 ' HB2' HD21 ' A' ' 33' ' ' LEU . 77.1 t80 -117.79 101.17 8.1 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.484 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 57.8 tt0 -105.8 121.52 44.21 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.303 -172.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.426 HD11 ' HE2' ' A' ' 72' ' ' TYR . 60.0 mt -101.88 130.31 51.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.421 -178.24 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.812 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 35.7 t -102.99 112.33 25.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.128 172.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.809 HD11 HD22 ' A' ' 114' ' ' LEU . 2.3 pp -113.22 28.47 8.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.89 0.376 . . . . 0.0 111.201 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.547 ' HB2' ' HB ' ' A' ' 44' ' ' VAL . 19.0 t70 -65.89 -73.91 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.319 176.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.35 -27.58 1.68 Allowed Glycine 0 N--CA 1.44 -1.041 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.892 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -85.67 131.34 34.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.24 0.543 . . . . 0.0 111.572 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -79.14 -38.97 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.52 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -68.96 -39.97 79.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.858 -165.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -77.97 -34.73 50.84 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 -176.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.598 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 22.7 t90 -62.19 -57.6 10.89 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.604 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -64.54 -38.91 92.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.928 -0.309 . . . . 0.0 111.691 -171.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -67.18 -43.53 81.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.999 0.428 . . . . 0.0 110.977 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.566 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.9 m -70.55 -24.37 62.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.811 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.775 ' HB1' HD11 ' A' ' 23' ' ' LEU . . . -87.8 -25.66 23.24 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.506 0.669 . . . . 0.0 110.099 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.3 -13.63 62.24 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.572 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -103.36 -3.49 25.45 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.832 174.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 86' ' ' SER . 41.4 mt -94.03 148.94 36.1 Favored Pre-proline 0 N--CA 1.447 -0.622 0 CA-C-O 121.361 0.6 . . . . 0.0 111.649 -175.313 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.865 ' HD3' HH21 ' A' ' 58' ' ' ARG . 24.7 Cg_endo -90.54 -37.95 0.05 OUTLIER 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 124.156 3.237 . . . . 0.0 113.875 -173.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.653 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.8 p90 -87.57 -169.05 2.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.206 -171.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.557 HG13 ' HG3' ' A' ' 28' ' ' ARG . 38.0 t -78.89 99.39 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-O 121.087 0.47 . . . . 0.0 110.112 -173.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.599 ' HB2' HD11 ' A' ' 23' ' ' LEU . 22.1 m -97.57 113.19 24.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.603 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.62 HG21 ' CE1' ' A' ' 72' ' ' TYR . 1.9 t -119.45 153.19 22.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.511 -170.343 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.463 ' HB2' ' CE2' ' A' ' 83' ' ' TRP . 7.8 tmm_? -124.02 140.0 53.4 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.456 ' HA ' HD13 ' A' ' 20' ' ' LEU . 16.1 t70 -81.92 158.61 23.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 -173.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.36 -34.53 31.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.028 -175.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.32 -12.66 8.59 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.159 -174.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 80.27 -120.17 5.12 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.688 175.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.09 -6.17 32.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 111.55 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -104.15 16.97 25.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.133 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.486 ' HB3' HG13 ' A' ' 106' ' ' ILE . 24.2 t -65.08 133.1 50.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.49 -178.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.484 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 12.0 m -62.53 -26.91 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.186 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.459 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 88.5 m-85 -63.53 -42.63 98.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.982 0.42 . . . . 0.0 110.019 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.654 HD11 HD22 ' A' ' 76' ' ' LEU . 52.3 mt -52.94 -42.27 43.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.999 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.8 m -71.93 -20.39 61.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.341 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 104' ' ' SER . 97.6 mt -81.2 -38.48 26.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.661 0.267 . . . . 0.0 111.406 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.459 ' HE2' ' HB3' ' A' ' 105' ' ' TYR . 77.3 m-85 -79.55 -25.21 41.72 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.882 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.809 HD22 HD11 ' A' ' 76' ' ' LEU . 2.4 mp . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 111.473 0.175 . . . . 0.0 111.473 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.519 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 3.9 Cg_exo -72.38 166.86 79.03 Favored 'Cis proline' 0 C--N 1.353 0.801 0 C-N-CA 123.712 -1.37 . . . . 0.0 111.914 -0.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.4 m -145.17 157.32 44.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.89 -177.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.548 ' O ' ' HA3' ' A' ' 130' ' ' GLY . 1.3 p -134.98 155.43 38.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.588 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 89.7 m-85 -145.56 153.57 41.23 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.856 ' HB3' ' HB3' ' A' ' 127' ' ' SER . 8.5 tp -122.07 150.35 42.26 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.488 -1.285 . . . . 0.0 112.217 -178.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.58 HG12 ' HA ' ' A' ' 126' ' ' LEU . 13.7 m -136.93 143.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.749 169.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.582 ' HB3' HD22 ' A' ' 143' ' ' LEU . 5.0 p30 -110.48 153.79 24.55 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.748 ' H ' HG22 ' A' ' 37' ' ' VAL . 21.4 ttp-105 49.8 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.785 1.303 . . . . 0.0 113.173 167.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.401 ' H ' ' HB3' ' A' ' 122' ' ' ARG . 9.4 m120 -97.56 30.54 2.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.768 -176.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.567 ' CB ' ' HG3' ' A' ' 34' ' ' LYS . 1.2 t-20 58.68 53.88 5.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.998 -178.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.569 ' HG3' ' ND2' ' A' ' 121' ' ' ASN . 1.6 pt-20 -109.08 128.73 55.24 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.379 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.58 ' HA ' HG12 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -52.07 116.4 2.17 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.688 0.618 . . . . 0.0 111.192 -173.619 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.856 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 24.8 t -71.76 -61.56 1.74 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.663 178.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.11 164.34 18.04 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.771 179.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.553 ' HB3' ' OE1' ' A' ' 131' ' ' GLU . 7.3 mmm180 -75.37 147.5 39.98 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.001 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 1.048 ' HA2' HG12 ' A' ' 133' ' ' ILE . . . -67.33 -21.74 72.43 Favored Glycine 0 CA--C 1.508 -0.385 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.985 -175.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.553 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.9 mp0 -67.1 -12.39 59.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.361 0.601 . . . . 0.0 109.547 173.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -117.62 -1.53 11.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.163 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 1.048 HG12 ' HA2' ' A' ' 130' ' ' GLY . 16.5 mm -84.39 94.79 3.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.411 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 14.7 ptmm? -50.27 -51.78 41.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.383 0.611 . . . . 0.0 110.206 176.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.411 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 4.8 m-20 -144.35 126.64 15.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.927 HD22 HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.85 -38.86 79.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.144 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.412 ' HB2' HD21 ' A' ' 60' ' ' LEU . 9.5 t70 -49.09 -58.42 4.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.771 176.064 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.01 -40.96 70.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.414 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.616 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.914 -175.429 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.705 HD11 HD12 ' A' ' 136' ' ' LEU . 24.1 mt -60.64 -46.08 96.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.691 0.758 . . . . 0.0 110.037 176.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.447 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 17.2 ttpt -56.99 -39.09 74.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.559 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.569 ' HE3' ' HA ' ' A' ' 139' ' ' ALA . 17.9 pttp -84.39 -19.94 32.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.526 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 13.8 mt -81.52 -29.56 33.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -175.086 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 87.0 mt . . . . . 0 C--N 1.32 -0.695 0 CA-C-O 121.356 0.598 . . . . 0.0 110.179 178.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.579 HG21 ' O ' ' A' ' 124' ' ' ASN . 9.0 pt . . . . . 0 N--CA 1.449 -0.481 0 CA-C-O 120.81 0.338 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.443 HG21 ' HD1' ' A' ' 105' ' ' TYR . 63.9 mt -111.2 104.59 17.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.65 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.1 107.38 8.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.475 0.655 . . . . 0.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.605 ' O ' ' HA ' ' A' ' 29' ' ' SER . 28.4 mm -83.38 126.0 40.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.622 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.639 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 38.5 mt-30 -129.45 95.27 3.97 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.822 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.559 HD22 ' C ' ' A' ' 19' ' ' GLN . 1.1 mm? -129.58 159.95 34.79 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.198 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.5 mtmt -85.68 143.8 28.18 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.093 0.473 . . . . 0.0 110.453 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.506 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 23.2 p30 -80.72 -171.13 2.97 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.457 -178.307 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.656 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 3.3 tm? -50.51 -41.27 53.3 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.187 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -75.73 -41.63 52.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.986 0.422 . . . . 0.0 110.977 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 15.65 2.42 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.645 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.454 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 15.5 m120 -87.92 118.05 27.2 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.226 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.8 m -64.59 107.52 1.42 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.201 0.524 . . . . 0.0 110.032 177.067 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.639 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 9.4 mmt180 -92.26 135.41 34.03 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.505 176.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.605 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 69.8 p -112.78 158.23 20.37 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 169.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.455 HD22 HG11 ' A' ' 38' ' ' VAL . 81.9 mt -68.1 -28.43 67.34 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.603 ' HA ' ' OD1' ' A' ' 124' ' ' ASN . 5.8 p -66.56 -17.14 64.65 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.037 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -81.85 -23.14 36.58 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.846 0.831 . . . . 0.0 109.171 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.62 HD23 HG13 ' A' ' 38' ' ' VAL . 2.4 tp -96.57 2.1 51.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.119 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -57.23 112.69 1.45 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.961 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.2 -41.97 1.12 Allowed Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 60.7 mttp -100.53 171.04 7.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.265 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.675 HG23 ' HD1' ' A' ' 69' ' ' PHE . 11.5 m -81.92 124.65 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 170.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.62 HG13 HD23 ' A' ' 33' ' ' LEU . 47.5 t -101.64 120.06 50.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.743 -170.378 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.582 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.5 tp -85.94 110.1 19.21 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.622 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 26.8 mm -84.38 105.12 13.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.509 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 10.3 t70 -108.52 110.65 22.2 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.68 -177.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.576 ' HB3' HD13 ' A' ' 114' ' ' LEU . 26.3 m-85 -98.23 100.31 11.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.781 174.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.485 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -136.27 -174.78 3.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.472 -176.359 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.635 ' CG1' ' HB3' ' A' ' 47' ' ' ASN . 12.0 p -133.18 133.03 58.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 177.544 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 1.026 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 42.4 m-85 -87.67 78.83 8.4 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -176.25 -38.55 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.849 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.635 ' HB3' ' CG1' ' A' ' 44' ' ' VAL . 5.0 t30 -90.07 133.24 34.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.519 -174.23 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.49 -22.39 32.33 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.987 -173.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.7 mtt -56.86 -30.36 63.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.868 0.366 . . . . 0.0 110.85 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.0 t -73.06 -23.03 60.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.949 -177.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.7 -58.78 5.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.797 0.332 . . . . 0.0 111.167 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.61 -31.42 68.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.26 0.552 . . . . 0.0 110.457 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.428 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.3 t60 -60.01 -41.7 92.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.726 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.6 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.2 m-20 -71.29 -20.91 62.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.795 -179.101 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.7 tt -72.47 -43.32 63.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.93 -37.35 82.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.384 0.612 . . . . 0.0 110.041 175.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 54' ' ' ASN . 91.0 mt -65.19 -41.43 94.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.805 176.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -57.49 -32.06 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.84 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.68 -55.44 5.65 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.795 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.61 -32.41 63.08 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.757 -2.019 . . . . 0.0 111.23 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -74.47 -47.86 30.87 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.223 0.535 . . . . 0.0 109.852 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -64.65 -20.75 66.48 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.685 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -78.82 -60.46 2.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.989 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.524 ' HB3' HD11 ' A' ' 144' ' ' LEU . 92.3 m-85 -114.29 -5.93 12.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 113.939 1.089 . . . . 0.0 113.939 -164.558 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.55 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -55.36 -38.05 68.31 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.299 0.499 . . . . 0.0 111.964 -175.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.2 p -66.65 -16.38 64.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.031 -176.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.483 ' HB2' HD13 ' A' ' 144' ' ' LEU . 3.6 mm-40 -96.65 4.45 51.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.793 0.33 . . . . 0.0 110.758 -174.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.87 45.78 1.25 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.622 -176.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.675 ' HD1' HG23 ' A' ' 37' ' ' VAL . 41.9 t80 -125.96 135.34 51.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.748 0.309 . . . . 0.0 110.3 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -140.43 147.5 39.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.971 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' A' ' 92' ' ' TRP . 55.8 mt -107.97 129.91 61.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.044 0.45 . . . . 0.0 110.082 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.417 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 83.1 t80 -110.8 99.83 8.68 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.509 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 19.3 tt0 -100.59 123.3 44.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.929 -173.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.407 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 27.6 mt -110.38 127.22 67.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.302 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . 1.026 ' HB3' ' HD1' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -84.97 141.52 30.29 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.177 0.298 . . . . 0.0 110.301 172.3 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.534 HD11 ' CD1' ' A' ' 114' ' ' LEU . 47.3 mt -96.0 -3.46 44.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 111.058 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.457 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 5.8 p-10 -90.36 -170.57 2.79 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.433 -174.444 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -136.47 29.18 2.81 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 173.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.33 125.88 41.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.882 0.372 . . . . 0.0 110.237 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.2 -43.87 23.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.66 -177.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.7 p80 -69.05 -42.95 75.61 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.162 -166.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -79.12 -38.23 36.63 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.278 -177.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.656 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 31.5 t90 -61.64 -51.25 69.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.06 0.457 . . . . 0.0 109.979 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.615 ' HA ' HD21 ' A' ' 23' ' ' LEU . 50.2 tttm -63.08 -52.85 61.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.219 -175.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.7 m -59.1 -35.17 72.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.995 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.477 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 24.2 t -85.17 -43.29 13.96 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.262 -178.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.601 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -80.67 -25.1 38.45 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -171.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -57.9 -31.86 67.16 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.824 0.345 . . . . 0.0 111.837 -175.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -109.29 13.98 24.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.467 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.496 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 17.9 mt -76.95 148.71 79.22 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.281 0.562 . . . . 0.0 111.937 -177.192 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.69 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -73.21 -41.5 1.26 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.648 2.899 . . . . 0.0 113.233 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.69 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.1 p90 -95.35 -171.72 2.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.837 0.351 . . . . 0.0 111.466 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.8 t -82.94 132.99 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.152 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.601 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 3.9 p -130.93 110.6 11.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -176.453 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.506 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 15.6 m -123.53 162.02 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.421 ' O ' HD12 ' A' ' 20' ' ' LEU . 52.4 ttp180 -124.03 129.87 51.63 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.136 -0.625 . . . . 0.0 112.271 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -106.5 111.29 23.78 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 171.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -71.22 -2.19 15.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.964 0.411 . . . . 0.0 111.318 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -103.35 10.05 37.63 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.23 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.505 ' HA3' ' HB3' ' A' ' 76' ' ' LEU . . . -64.26 76.14 0.06 OUTLIER Glycine 0 CA--C 1.522 0.521 0 N-CA-C 114.425 0.53 . . . . 0.0 114.425 -173.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 168.54 -29.74 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.649 1.18 . . . . 0.0 107.974 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -126.2 14.4 7.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.946 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.525 ' HB3' HG13 ' A' ' 106' ' ' ILE . 7.4 t -70.12 135.18 48.93 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.635 -171.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.463 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 1.4 m -54.11 -33.4 57.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.03 -177.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.502 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 29.8 m-85 -68.67 -44.45 74.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.25 -175.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.525 HG13 ' HB3' ' A' ' 103' ' ' SER . 66.3 mt -53.25 -46.34 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.837 -173.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 11.2 m -67.84 -31.12 70.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.95 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.0 mt -70.28 -26.83 63.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 0.0 110.751 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.616 ' O ' ' HB3' ' A' ' 110' ' ' ASN . 84.0 m-85 -81.8 -2.68 51.71 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.121 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.616 ' HB3' ' O ' ' A' ' 109' ' ' TYR . 3.2 t30 . . . . . 0 N--CA 1.477 0.92 0 O-C-N 124.039 0.837 . . . . 0.0 109.788 -177.076 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.743 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 88.6 mt . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.743 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.0 Cg_endo -70.84 156.47 95.71 Favored 'Cis proline' 0 C--N 1.362 1.249 0 CA-C-N 120.77 1.311 . . . . 0.0 114.028 1.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 69.1 m -156.88 146.38 20.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.83 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.497 HG12 ' HA3' ' A' ' 130' ' ' GLY . 3.3 p -103.91 156.93 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.622 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 77.0 m-85 -141.09 164.97 28.84 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.967 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 10.7 tp -111.73 138.53 48.18 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.531 -175.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.465 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 4.9 t -131.13 117.79 38.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.22 0.533 . . . . 0.0 110.005 171.297 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -69.15 161.39 29.21 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.635 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.543 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 25.3 mtm180 -53.94 -20.69 6.49 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -171.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.526 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 56.0 t30 -83.46 5.09 25.01 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.603 ' OD1' ' HA ' ' A' ' 31' ' ' THR . 1.4 m120 63.64 60.68 1.07 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.664 -167.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.532 ' HA ' HG21 ' A' ' 15' ' ' ILE . 56.3 mt-10 -126.2 118.15 24.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.352 179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.462 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.9 OUTLIER -57.58 109.04 0.63 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.392 0.615 . . . . 0.0 109.36 176.368 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.967 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -82.43 -48.59 10.92 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.486 -172.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -175.7 172.93 2.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.286 -178.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.575 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 78.7 mtt85 -90.89 156.65 17.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.074 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.497 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -59.33 -38.58 93.55 Favored Glycine 0 C--O 1.228 -0.221 0 C-N-CA 121.521 -0.371 . . . . 0.0 112.567 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.575 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.2 OUTLIER -79.46 -19.21 50.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.46 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.532 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -86.59 -19.58 29.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.511 0.672 . . . . 0.0 109.498 179.871 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.505 HD11 ' HB2' ' A' ' 119' ' ' LEU . 83.2 mt -92.28 123.27 44.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.562 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -57.12 -45.09 83.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.692 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.593 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 2.4 p-10 -156.61 128.66 7.36 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.565 ' O ' HG13 ' A' ' 140' ' ' ILE . 6.8 mp -75.31 -25.87 58.21 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.594 -174.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.518 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.0 t70 -50.74 -58.38 6.05 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 123.475 0.485 . . . . 0.0 109.931 174.143 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.593 ' HB2' ' OD2' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -55.96 -41.69 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.12 175.888 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.402 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -65.32 -52.61 52.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.82 -175.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.795 HD12 HD12 ' A' ' 60' ' ' LEU . 45.8 mt -59.96 -42.34 89.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.61 0.719 . . . . 0.0 109.878 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.9 ttpt -57.58 -40.03 78.1 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.331 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -84.67 -24.67 28.9 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.945 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 30.8 mt -66.45 -40.72 89.59 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-O 120.958 0.409 . . . . 0.0 110.164 175.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 64' ' ' TYR . 95.9 mt . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.948 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 tp . . . . . 0 N--CA 1.448 -0.569 0 CA-C-O 121.591 0.71 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.765 ' H ' HD13 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -90.18 136.26 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.582 177.881 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -104.7 107.61 18.65 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.61 ' O ' ' HA ' ' A' ' 29' ' ' SER . 33.8 mt -92.47 110.53 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.252 -175.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -108.63 100.64 9.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.131 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.717 ' HB2' HG11 ' A' ' 95' ' ' VAL . 39.1 mt -139.33 166.4 24.64 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.685 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 34.2 mttm -96.5 150.26 20.82 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 121.129 0.49 . . . . 0.0 110.988 177.388 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.4 OUTLIER -82.55 -171.88 3.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.192 179.104 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 1.039 HD13 ' HA ' ' A' ' 88' ' ' ASP . 1.0 OUTLIER -49.28 -44.74 44.24 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.807 177.991 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -79.83 -20.41 46.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.011 -176.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.61 7.92 27.19 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.059 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -82.58 113.31 20.21 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.965 0.412 . . . . 0.0 110.377 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.685 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 24.9 m -69.76 119.86 14.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.542 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 14.8 mmm180 -110.27 138.67 46.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.773 177.049 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.61 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 12.0 p -119.39 164.27 15.97 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 174.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.548 HD22 HG11 ' A' ' 38' ' ' VAL . 33.5 mt -80.3 -34.03 37.14 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.415 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.5 p -65.05 -16.78 63.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.226 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -78.2 -37.49 45.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.865 0.841 . . . . 0.0 109.082 177.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.478 HD23 HG13 ' A' ' 38' ' ' VAL . 3.7 tp -81.44 5.65 16.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.487 -1.233 . . . . 0.0 111.427 -173.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -62.83 114.73 3.81 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.126 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.71 -39.74 1.0 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 -174.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.638 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 84.6 mttt -104.15 170.89 7.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 172.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.795 HG23 ' HD1' ' A' ' 69' ' ' PHE . 15.8 m -83.57 125.95 40.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 168.058 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.548 HG11 HD22 ' A' ' 30' ' ' LEU . 59.8 t -101.64 123.74 54.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.312 0.577 . . . . 0.0 111.664 -168.659 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 39' ' ' LEU . 12.4 tp -89.25 121.27 31.38 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.113 172.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.588 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -97.91 105.13 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.457 177.812 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.604 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 12.7 t70 -102.36 128.68 48.83 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.411 -177.106 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -121.77 97.7 5.61 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 176.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.803 ' O ' ' HA ' ' A' ' 75' ' ' SER . 31.1 m -138.66 147.41 42.81 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.758 -170.396 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.575 HG12 ' HG ' ' A' ' 76' ' ' LEU . 29.7 m -96.04 119.54 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 121.315 0.578 . . . . 0.0 109.998 173.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.528 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 5.5 m-85 -73.01 85.34 1.29 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.97 177.633 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 t30 173.94 -36.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.638 -172.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -74.04 150.87 40.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.613 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.89 -29.67 68.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -173.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.3 mtt -66.75 -20.48 65.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.601 0.239 . . . . 0.0 110.504 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.1 t -58.67 -29.17 66.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.109 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.63 -55.2 21.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.89 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.66 -30.86 64.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.53 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 82.5 t60 -69.49 -37.53 77.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -63.29 -38.62 91.88 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.282 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.13 -52.02 65.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.15 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.53 90.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.137 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 89.7 mt -62.9 -42.07 99.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.2 0.524 . . . . 0.0 109.912 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.84 -31.75 71.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.919 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.429 ' HG2' ' HE3' ' A' ' 63' ' ' LYS . 7.7 tt0 -75.94 -56.15 4.94 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 -172.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.833 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -54.69 -32.2 59.08 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.417 -2.174 . . . . 0.0 111.289 178.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -77.96 -50.62 11.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.139 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.412 HD22 ' N ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -65.14 -21.78 66.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.045 0.45 . . . . 0.0 110.865 -176.871 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HE3' ' HG2' ' A' ' 59' ' ' GLU . 89.8 mttt -77.3 -55.08 5.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.113 177.195 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.576 ' HB3' HD11 ' A' ' 144' ' ' LEU . 94.0 m-85 -113.79 -9.26 13.14 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -164.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.567 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -54.56 -43.34 71.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.403 ' HB2' ' OE1' ' A' ' 67' ' ' GLN . 12.2 m -67.77 -18.62 64.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.824 -175.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.437 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 0.9 OUTLIER -95.45 4.8 52.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.811 -179.108 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.59 51.57 0.7 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.637 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.795 ' HD1' HG23 ' A' ' 37' ' ' VAL . 56.6 t80 -127.85 143.07 51.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.615 0.245 . . . . 0.0 110.386 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.638 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.38 147.63 38.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.134 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.464 HD12 ' CE3' ' A' ' 92' ' ' TRP . 68.3 mt -112.96 117.77 56.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.156 0.503 . . . . 0.0 110.09 175.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.524 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 81.0 t80 -100.74 99.93 10.54 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 175.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.604 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 12.0 tm0? -91.12 143.37 26.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.828 -173.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.425 HD11 ' HE2' ' A' ' 72' ' ' TYR . 65.5 mt -136.86 121.61 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.803 ' HA ' ' O ' ' A' ' 43' ' ' THR . 89.3 p -99.99 121.13 40.88 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 121.524 0.678 . . . . 0.0 110.973 177.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.6 HD13 HD11 ' A' ' 106' ' ' ILE . 0.6 OUTLIER -101.56 43.29 1.07 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.123 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -77.48 -169.76 1.55 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.326 -1.306 . . . . 0.0 111.648 -174.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -129.18 21.39 5.2 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.603 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.413 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 28.0 t70 -162.64 115.14 1.63 Allowed 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.304 0.573 . . . . 0.0 110.236 -177.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.553 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 18.1 tt0 -77.35 -14.33 59.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.157 -176.071 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' HIS . . . . . 0.413 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 56.3 m80 -68.68 -56.85 6.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.793 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -60.61 -47.86 84.35 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 120.859 0.362 . . . . 0.0 110.067 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.528 ' CH2' ' HB2' ' A' ' 96' ' ' ARG . 39.5 t90 -55.51 -52.45 63.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.506 179.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.553 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 24.9 ttmt -65.8 -47.77 73.98 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.421 -174.15 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.8 p -62.98 -34.96 78.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.03 0.443 . . . . 0.0 111.317 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.1 m -78.43 -48.5 15.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.452 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.82 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -88.79 -21.05 23.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -168.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 1.039 ' HA ' HD13 ' A' ' 23' ' ' LEU . 28.2 t70 -57.93 -31.12 66.51 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -168.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -101.58 16.22 26.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.34 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.572 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 25.9 mt -81.25 157.65 70.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.09 0.472 . . . . 0.0 111.745 -178.551 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.628 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 56.1 Cg_endo -64.24 -52.15 1.72 Allowed 'Trans proline' 0 N--CA 1.477 0.536 0 C-N-CA 124.148 3.232 . . . . 0.0 113.575 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.628 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 13.1 p90 -89.55 179.02 6.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.227 0.537 . . . . 0.0 111.668 -173.634 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.542 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 48.4 t -76.48 123.68 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.102 -176.156 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.773 ' HB2' HD11 ' A' ' 23' ' ' LEU . 62.5 m -116.98 109.08 16.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.126 0.488 . . . . 0.0 110.131 -178.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.717 HG11 ' HB2' ' A' ' 20' ' ' LEU . 11.1 t -114.73 159.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.304 -172.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.528 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 31.3 ttt180 -122.02 142.15 50.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.737 0.303 . . . . 0.0 110.579 179.163 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -83.6 142.72 30.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.19 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.38 -5.58 58.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -172.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 91.7 m-20 -119.95 -13.73 9.0 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.051 -0.66 . . . . 0.0 112.568 -175.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 57.24 82.71 0.05 OUTLIER Glycine 0 CA--C 1.522 0.525 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.339 174.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.555 ' H ' ' HB2' ' A' ' 76' ' ' LEU . . . 74.35 -29.06 0.19 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.436 0.694 . . . . 0.0 111.556 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -85.38 21.57 1.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.537 ' HB3' HG13 ' A' ' 106' ' ' ILE . 38.3 t -61.56 144.51 54.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.811 -173.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.552 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 15.9 m -72.75 -29.89 63.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.741 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.413 ' HA ' HD12 ' A' ' 108' ' ' LEU . 88.2 m-85 -68.71 -40.7 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.445 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.6 HD11 HD13 ' A' ' 76' ' ' LEU . 74.2 mt -55.49 -34.3 34.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.834 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.5 m -80.44 -27.14 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.0 mt -68.55 -42.09 78.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.268 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.575 ' OH ' HG13 ' A' ' 16' ' ' ILE . 37.2 m-85 -80.58 -20.4 43.43 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.501 178.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 . . . . . 0 CA--C 1.514 -0.435 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -169.0 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.466 ' HG ' ' CD1' ' A' ' 76' ' ' LEU . 3.9 mm? . . . . . 0 C--O 1.234 0.268 0 N-CA-C 110.651 -0.129 . . . . 0.0 110.651 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.488 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 12.5 Cg_exo -73.42 156.02 99.65 Favored 'Cis proline' 0 C--N 1.349 0.57 0 C-N-CA 123.69 -1.379 . . . . 0.0 112.418 -0.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.5 m -140.26 170.08 16.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.286 -177.39 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.35 155.75 16.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.836 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.588 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 90.2 m-85 -138.1 157.73 45.75 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.697 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -111.46 141.85 44.49 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -177.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.532 HG23 HD11 ' A' ' 40' ' ' ILE . 6.8 t -138.7 129.4 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 174.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.639 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 4.6 p30 -85.45 170.61 12.51 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.063 178.354 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.531 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 13.4 ptt180 -52.72 -23.2 6.26 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -170.282 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -81.61 3.29 25.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.733 0.302 . . . . 0.0 110.24 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.411 HD22 ' HA ' ' A' ' 124' ' ' ASN . 2.1 t-20 65.93 53.28 1.13 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.598 -171.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.639 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 41.3 mt-10 -124.73 137.66 54.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.916 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 4.2 tt -68.18 109.31 3.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.318 0.58 . . . . 0.0 109.606 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.697 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 23.4 m -71.55 -57.84 4.04 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.237 -177.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.01 171.83 15.93 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.78 -175.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.584 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -98.75 146.06 26.29 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.783 -178.977 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -50.39 -26.69 10.09 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 121.528 -0.367 . . . . 0.0 113.041 178.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.77 -44.06 94.53 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.978 0.511 . . . . 0.0 111.592 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -104.51 -6.63 20.44 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -170.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.783 HG21 ' HG ' ' A' ' 136' ' ' LEU . 80.2 mt -76.57 100.44 2.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.193 0.52 . . . . 0.0 109.855 175.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.55 -50.07 75.0 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.044 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -139.59 109.07 6.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.978 -177.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.783 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.7 mp -70.46 -37.4 74.29 Favored 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.424 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.455 ' HA ' HD11 ' A' ' 60' ' ' LEU . 9.6 t70 -53.2 -52.33 59.21 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.591 177.051 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -64.16 -41.55 97.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.276 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.682 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -62.99 -50.73 69.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.853 -176.351 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.833 HD12 HD12 ' A' ' 60' ' ' LEU . 43.1 mt -61.15 -37.03 76.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.377 0.608 . . . . 0.0 110.272 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -61.94 -41.23 97.73 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.278 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.682 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -81.4 -19.51 42.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 111.193 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 75.4 mt -74.29 -39.54 62.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.809 176.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.576 HD11 ' HB3' ' A' ' 64' ' ' TYR . 65.4 mt . . . . . 0 C--N 1.326 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.423 -177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.847 HG21 ' H ' ' A' ' 126' ' ' LEU . 34.5 pt . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.435 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.0 mp -86.41 89.71 2.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.86 115.43 9.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.694 174.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.502 HD11 ' OH ' ' A' ' 109' ' ' TYR . 7.0 mt -104.26 122.11 56.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.837 -177.322 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.636 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 2.2 mp0 -112.71 100.5 8.75 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.198 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.43 ' HG ' HG22 ' A' ' 18' ' ' ILE . 71.1 mt -132.81 156.19 47.58 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 97.1 mttt -82.3 138.02 34.67 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.886 0.374 . . . . 0.0 111.465 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -88.96 -167.66 1.95 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.87 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.593 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 55.4 tp -50.39 -36.86 34.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.77 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -77.74 -10.09 59.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.967 0.413 . . . . 0.0 111.805 -178.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.77 18.17 60.37 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -100.55 123.57 44.94 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.631 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 4.7 m -64.48 115.63 5.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.468 0.651 . . . . 0.0 111.367 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.636 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.6 mmm180 -88.06 142.67 27.59 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.851 172.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.63 ' CB ' ' HG3' ' A' ' 19' ' ' GLN . 1.5 m -124.01 138.56 54.44 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.253 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.543 HD22 HG11 ' A' ' 38' ' ' VAL . 50.5 mt -63.82 -32.92 74.59 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.026 178.104 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.8 0.05 14.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.258 177.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -105.27 -41.95 5.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.531 0.682 . . . . 0.0 109.339 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.47 ' CD1' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -78.83 -0.16 29.48 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.427 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.517 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 24.6 ttpp -63.09 102.87 0.41 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.714 176.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.86 -30.49 0.21 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -175.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.556 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -113.63 174.2 6.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 167.865 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.446 HG23 ' HD1' ' A' ' 69' ' ' PHE . 21.3 m -80.93 129.26 37.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.649 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 47.6 t -101.0 116.3 44.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.193 0.52 . . . . 0.0 110.812 -171.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.568 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 14.1 tp -82.84 111.75 19.03 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.622 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 27.4 mm -83.98 105.29 13.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.593 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 16.2 t70 -108.62 130.08 55.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.791 -178.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.585 ' HB3' HD21 ' A' ' 114' ' ' LEU . 51.5 m-85 -117.69 116.25 26.68 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 173.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.571 ' O ' ' HA ' ' A' ' 75' ' ' SER . 14.7 t -149.36 -176.44 5.38 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 -178.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.654 HG13 ' HB2' ' A' ' 47' ' ' ASN . 1.7 p -131.95 117.89 35.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 176.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.575 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 28.2 m-85 -77.42 79.33 3.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 122.173 0.987 . . . . 0.0 109.329 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.521 ' HB3' HG22 ' A' ' 44' ' ' VAL . 21.3 t-20 178.1 -27.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.208 -1.815 . . . . 0.0 109.297 -177.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.654 ' HB2' HG13 ' A' ' 44' ' ' VAL . 25.3 t-20 -86.16 141.09 29.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.72 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -25.8 66.6 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.163 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 94.5 mmm -68.43 -17.41 64.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.528 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.8 t -71.99 -28.48 63.44 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.64 -55.14 38.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.23 -26.39 63.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.245 0.545 . . . . 0.0 110.831 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.437 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 83.6 t60 -70.21 -45.52 66.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.524 -179.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.592 ' HA ' HD12 ' A' ' 57' ' ' LEU . 8.0 m120 -64.31 -28.05 69.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.986 178.218 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -62.8 -55.09 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.609 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.37 74.82 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.592 HD12 ' HA ' ' A' ' 54' ' ' ASN . 90.2 mt -63.56 -41.09 98.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.067 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -61.95 -30.32 70.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.092 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.32 -51.86 12.2 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -174.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 140' ' ' ILE . 2.4 mm? -58.05 -29.99 65.8 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 112.673 -2.058 . . . . 0.0 111.299 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -78.68 -50.35 11.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.028 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -60.6 -21.95 63.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.202 0.525 . . . . 0.0 110.613 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -79.56 -57.1 3.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.412 177.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.671 ' HB3' HD11 ' A' ' 144' ' ' LEU . 91.3 m-85 -112.64 -8.65 13.79 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -165.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.554 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -68.99 169.83 11.0 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.115 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.3 m 70.06 -35.04 0.3 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.744 0.652 . . . . 0.0 110.799 -174.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.519 ' H ' ' C ' ' A' ' 65' ' ' ALA . 23.1 mt-30 -82.25 16.88 1.83 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.716 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.96 18.04 14.86 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.994 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.568 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 66.8 t80 -107.61 144.49 34.57 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.556 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 8.7 tp10 -145.06 156.09 43.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.463 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' A' ' 92' ' ' TRP . 48.3 mt -120.26 129.49 75.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.062 0.458 . . . . 0.0 110.001 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.448 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 78.5 t80 -117.8 101.01 7.96 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.405 178.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.593 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 39.2 mt-30 -92.74 144.15 25.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.473 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.5 mt -123.66 116.4 48.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.329 172.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.575 ' HB3' ' HD1' ' A' ' 45' ' ' TYR . 62.7 p -92.11 134.51 34.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.377 . . . . 0.0 110.993 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.6 HD12 HD22 ' A' ' 114' ' ' LEU . 50.2 mt -104.65 37.35 2.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.311 0.577 . . . . 0.0 109.623 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.524 ' HA ' HG23 ' A' ' 44' ' ' VAL . 3.5 p30 -87.38 172.05 10.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.861 -173.257 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -125.85 34.36 3.3 Favored Glycine 0 N--CA 1.442 -0.925 0 N-CA-C 110.056 -1.217 . . . . 0.0 110.056 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -149.55 101.92 3.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.17 0.51 . . . . 0.0 109.906 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -76.57 -25.71 54.3 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.654 -174.189 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -74.34 -30.38 62.0 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.234 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -76.14 -47.62 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.865 174.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.593 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 59.3 t90 -56.37 -42.02 77.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.632 176.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.539 ' HA ' ' CD1' ' A' ' 23' ' ' LEU . 22.5 ttmm -67.14 -51.78 49.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.315 -179.121 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 m -69.36 -22.0 63.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 0.0 111.402 -175.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.482 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 22.8 t -85.08 -35.12 22.04 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.262 . . . . 0.0 110.682 178.229 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.542 ' HA ' HD12 ' A' ' 90' ' ' LEU . . . -79.5 -17.93 53.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.658 -176.486 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -50.15 -45.74 53.45 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.53 0.519 . . . . 0.0 112.116 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -100.07 14.86 29.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.331 -176.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.542 HD12 ' HA ' ' A' ' 87' ' ' ALA . 22.5 mt -88.09 144.73 34.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.38 0.609 . . . . 0.0 111.923 -176.403 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.692 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 59.7 Cg_endo -80.89 -38.9 0.24 Allowed 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.828 3.019 . . . . 0.0 113.687 -176.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.692 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.2 p90 -101.17 -169.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.166 -171.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.51 HG11 ' HG3' ' A' ' 28' ' ' ARG . 46.7 t -91.93 131.42 39.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.791 0.329 . . . . 0.0 110.689 -172.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 85.4 m -130.31 114.91 16.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.284 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.605 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.4 m -115.97 165.74 10.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -121.92 144.51 48.82 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.349 -179.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -89.17 157.21 18.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.35 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.1 -33.39 29.77 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -174.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.59 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 53.7 t30 -118.13 -12.21 10.05 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.499 -171.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.9 -128.26 8.5 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.657 175.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.5 4.01 5.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.59 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 20.7 m-85 -111.69 13.02 21.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.97 0.414 . . . . 0.0 109.949 178.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.2 t -64.74 137.43 57.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.443 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 14.8 m -64.36 -24.24 67.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.018 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -61.08 -46.13 91.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.958 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.9 mt -61.54 -31.23 50.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.075 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 14.3 m -71.18 -23.05 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.349 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.33 -17.27 46.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.502 ' OH ' HD11 ' A' ' 18' ' ' ILE . 90.4 m-85 -89.49 -20.59 23.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.198 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 32.3 t30 . . . . . 0 C--N 1.331 -0.239 0 CA-C-O 122.204 1.002 . . . . 0.0 108.708 -167.313 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.6 HD22 HD12 ' A' ' 76' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 27.4 Cg_endo -62.94 153.28 69.31 Favored 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.296 -1.127 . . . . 0.0 113.621 0.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.4 m -137.33 170.67 15.69 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.271 -177.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.5 p -142.44 153.69 18.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.622 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 64.1 m-85 -140.85 164.8 29.25 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 1.016 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 9.9 tp -110.7 134.5 52.4 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.649 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 10.3 t -125.93 117.25 48.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.421 0.629 . . . . 0.0 110.532 171.011 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.488 ' HA ' HD13 ' A' ' 143' ' ' LEU . 18.4 t30 -68.9 161.76 28.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.283 177.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -17.66 10.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -169.554 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -90.95 14.79 12.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.005 0.431 . . . . 0.0 110.17 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.517 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 1.0 OUTLIER 59.0 58.96 2.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.025 -175.182 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.502 ' HA ' HG21 ' A' ' 15' ' ' ILE . 32.5 mt-10 -124.22 123.77 40.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.054 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.847 ' H ' HG21 ' A' ' 15' ' ' ILE . 19.6 mt -56.52 107.21 0.36 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.417 0.627 . . . . 0.0 110.016 172.611 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' SER . . . . . 1.016 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 49.5 m -79.7 -42.47 24.6 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.681 -175.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 179.96 172.74 1.01 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.392 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.505 ' O ' HG13 ' A' ' 133' ' ' ILE . 86.7 mtm180 -103.59 159.25 15.76 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.909 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -47.23 -43.83 19.43 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 114.327 0.491 . . . . 0.0 114.327 -174.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -72.55 -29.68 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.095 0.474 . . . . 0.0 111.379 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.413 ' OD1' ' HB2' ' A' ' 129' ' ' ARG . 8.9 m120 -79.54 -26.44 41.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.829 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.862 HG21 ' HG ' ' A' ' 136' ' ' LEU . 78.3 mt -82.01 112.3 19.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.877 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.449 ' N ' ' HD2' ' A' ' 134' ' ' LYS . 3.3 mptp? -90.44 98.11 11.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.984 174.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.93 106.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.131 -176.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.862 ' HG ' HG21 ' A' ' 133' ' ' ILE . 6.0 mp -70.07 -25.37 63.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.518 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -50.59 -52.64 37.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.375 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.52 -44.14 95.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.046 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.472 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -57.83 -53.88 53.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.698 -176.046 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.843 HD12 HD12 ' A' ' 60' ' ' LEU . 42.4 mt -60.37 -39.96 82.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.007 0.432 . . . . 0.0 111.115 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 3.9 ttmp? -58.5 -44.36 89.39 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.744 -178.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -78.94 -24.45 43.96 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.769 -176.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 121' ' ' ASN . 27.5 mt -72.18 -38.14 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.24 0.543 . . . . 0.0 110.372 175.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.671 HD11 ' HB3' ' A' ' 64' ' ' TYR . 28.6 mt . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.001 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.699 HG21 ' O ' ' A' ' 124' ' ' ASN . 6.9 tt . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.502 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.9 mp -97.26 138.01 23.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -92.64 108.48 20.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.558 HD11 ' OH ' ' A' ' 109' ' ' TYR . 8.9 mt -89.47 115.4 29.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.352 -177.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -111.91 100.16 8.68 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.517 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.704 ' HB2' HG11 ' A' ' 95' ' ' VAL . 22.2 mt -136.08 162.42 32.96 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.636 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.1 mttm -90.83 147.47 23.16 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.67 0.747 . . . . 0.0 111.17 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.59 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.7 OUTLIER -84.27 -173.51 4.76 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.625 -174.036 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.86 HD11 ' HA ' ' A' ' 84' ' ' LYS . 15.0 tp -54.29 -42.73 70.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.616 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.509 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.02 -39.92 83.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.601 178.314 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.471 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 124.12 13.91 3.87 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.172 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -96.7 125.44 41.16 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 122.818 -0.225 . . . . 0.0 110.536 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.636 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 7.8 m -63.33 113.6 3.32 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.407 0.622 . . . . 0.0 110.586 177.276 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.514 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 9.4 mmm180 -102.16 127.97 48.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.246 177.103 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 57.6 p -115.67 158.42 22.77 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 174.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.529 HD22 HG11 ' A' ' 38' ' ' VAL . 79.0 mt -74.07 -29.12 61.72 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.4 p -63.37 -22.6 66.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.569 175.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -91.13 -34.42 15.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.602 0.715 . . . . 0.0 109.724 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.681 HD11 ' HG2' ' A' ' 70' ' ' GLU . 11.9 tp -82.01 10.04 7.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.857 -177.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -64.18 -11.17 28.25 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.591 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.36 -18.46 65.38 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.1 -178.31 4.77 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.891 0.377 . . . . 0.0 110.266 177.271 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.674 HG23 ' HD1' ' A' ' 69' ' ' PHE . 16.6 m -85.36 126.83 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 168.421 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.529 HG11 HD22 ' A' ' 30' ' ' LEU . 38.7 t -101.04 129.18 52.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.27 0.557 . . . . 0.0 111.663 -167.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.761 HD11 HD21 ' A' ' 136' ' ' LEU . 12.4 tp -95.72 110.58 22.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.512 173.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.557 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.0 mm -84.77 105.78 14.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -114.04 129.82 56.59 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.898 -175.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -116.58 97.78 6.19 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.76 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 m -137.95 141.45 40.54 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.212 0.53 . . . . 0.0 111.518 -170.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.66 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.1 OUTLIER -95.63 118.22 41.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.018 -177.799 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.793 ' HE1' HE21 ' A' ' 73' ' ' GLN . 25.2 m-85 -77.26 80.74 3.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.662 0.744 . . . . 0.0 109.708 174.389 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.479 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 19.7 t-20 174.35 -33.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.855 -176.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.66 ' HB2' HG13 ' A' ' 44' ' ' VAL . 8.0 t-20 -73.4 148.85 42.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.031 -176.374 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.43 -33.54 71.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.807 -178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.1 tpp -67.58 -26.79 66.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.061 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.7 m -60.99 -32.97 72.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.997 -175.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.69 95.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.842 0.353 . . . . 0.0 111.191 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.66 -29.49 45.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.098 0.475 . . . . 0.0 110.572 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.445 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 85.5 t60 -65.85 -42.41 90.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.819 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.401 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.5 m-20 -66.23 -21.44 66.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.591 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.2 tm? -64.14 -54.92 26.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.416 0.627 . . . . 0.0 109.91 176.699 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.18 -33.11 72.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.8 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 86.8 mt -65.15 -40.45 94.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.804 176.277 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.451 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.1 tpt180 -59.28 -33.51 71.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.778 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.81 -55.1 6.18 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -172.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.81 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.2 -31.91 61.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 112.846 -1.979 . . . . 0.0 111.624 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.404 ' HD1' HG13 ' A' ' 71' ' ' ILE . 24.9 t80 -77.97 -48.8 15.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.978 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.406 ' N ' HD22 ' A' ' 62' ' ' ASN . 1.0 OUTLIER -63.79 -21.68 66.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.548 -177.588 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -77.36 -58.62 3.17 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.91 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.623 ' CE1' ' HG3' ' A' ' 141' ' ' LYS . 96.2 m-85 -109.14 -10.65 14.98 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -165.176 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -53.65 -37.87 63.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.219 0.463 . . . . 0.0 111.849 -176.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.4 m -67.64 -15.21 63.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -107.99 9.61 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 0.0 111.054 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.439 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 104.88 48.97 1.04 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.912 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.674 ' HD1' HG23 ' A' ' 37' ' ' VAL . 72.4 t80 -121.92 138.77 54.28 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.681 ' HG2' HD11 ' A' ' 33' ' ' LEU . 8.7 tp10 -138.69 146.03 41.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.287 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.422 HD12 ' CE3' ' A' ' 92' ' ' TRP . 72.2 mt -112.41 124.64 69.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.927 0.394 . . . . 0.0 110.239 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.595 ' CE1' HG21 ' A' ' 95' ' ' VAL . 89.9 t80 -104.5 100.0 9.68 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.793 HE21 ' HE1' ' A' ' 45' ' ' TYR . 7.0 tp60 -83.49 136.67 34.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.861 -177.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -125.78 108.32 19.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.76 ' HA ' ' O ' ' A' ' 43' ' ' THR . 66.5 p -83.11 126.3 32.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.309 0.576 . . . . 0.0 111.189 -175.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.519 HD22 ' H ' ' A' ' 101' ' ' ALA . 17.3 mt -102.94 39.36 1.56 Allowed 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.128 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.594 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.8 p-10 -61.42 -71.91 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.266 -170.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.41 12.25 42.3 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -170.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -163.1 100.47 0.97 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.9 -26.37 61.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.008 -171.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -74.02 -29.1 61.76 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.694 -0.803 . . . . 0.0 110.89 -174.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -71.68 -48.9 44.38 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.579 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 27.9 t90 -60.67 -47.19 87.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.293 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.86 ' HA ' HD11 ' A' ' 23' ' ' LEU . 12.2 ttmt -62.35 -45.33 93.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.639 0.257 . . . . 0.0 111.497 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -68.12 -31.23 70.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.461 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.4 p -85.58 -33.67 21.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.897 0.38 . . . . 0.0 111.651 -177.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.522 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -86.32 -18.92 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.604 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 15.1 t70 -64.12 -27.05 68.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.899 0.381 . . . . 0.0 111.789 -173.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -97.0 8.23 44.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.282 0.563 . . . . 0.0 110.419 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.3 mt -86.89 152.21 53.32 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.179 0.514 . . . . 0.0 111.726 -177.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.594 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -72.53 -58.67 0.07 OUTLIER 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.691 2.928 . . . . 0.0 114.046 -176.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.594 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.9 p90 -83.35 -173.79 4.91 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.064 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.98 124.63 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 m -117.94 109.47 16.54 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.704 HG11 ' HB2' ' A' ' 20' ' ' LEU . 11.3 t -115.99 156.56 17.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.814 -176.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.427 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 14.8 ttp180 -113.21 139.62 48.63 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.487 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.67 156.99 20.44 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.955 0.407 . . . . 0.0 110.065 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.04 -29.17 32.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -114.26 -14.1 12.3 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -171.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.405 ' O ' ' HB3' ' A' ' 101' ' ' ALA . . . 67.56 78.03 0.3 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.486 178.259 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.519 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 80.42 -31.53 0.12 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.878 0.871 . . . . 0.0 111.897 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -85.01 37.34 0.66 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.344 0.593 . . . . 0.0 110.016 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.547 ' HB3' HG13 ' A' ' 106' ' ' ILE . 22.8 t -89.7 141.95 28.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.126 -172.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.438 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 2.9 p -61.28 -38.22 85.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.178 178.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -55.35 -44.48 75.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.377 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.547 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.5 mt -64.27 -28.94 46.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.011 -176.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 27.9 m -77.8 -24.76 48.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.582 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.9 mt -71.18 -37.23 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.993 -179.065 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.558 ' OH ' HD11 ' A' ' 18' ' ' ILE . 93.3 m-85 -69.87 -23.14 63.22 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.292 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 38.2 t30 . . . . . 0 C--N 1.327 -0.378 0 CA-C-O 122.384 1.088 . . . . 0.0 108.801 -167.327 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.642 HD13 ' OG ' ' A' ' 116' ' ' SER . 3.0 mm? . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.429 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 24.1 Cg_exo -65.26 152.52 77.46 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 124.474 -1.052 . . . . 0.0 112.655 0.31 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.642 ' OG ' HD13 ' A' ' 114' ' ' LEU . 13.0 m -127.55 166.12 18.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.036 -175.05 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 40' ' ' ILE . 7.9 p -143.28 154.56 16.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.181 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.557 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 84.4 m-85 -139.02 163.74 31.6 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 176.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.897 HD13 HD11 ' A' ' 136' ' ' LEU . 14.7 tp -110.53 135.43 51.2 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 44.9 t -133.62 125.08 49.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.754 0.312 . . . . 0.0 110.484 176.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.577 ' HB3' HD22 ' A' ' 143' ' ' LEU . 8.9 p30 -82.9 166.75 18.65 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -75.31 18.62 0.2 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -169.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.467 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 63.4 t30 -95.22 -0.86 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 166.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.699 ' O ' HG21 ' A' ' 15' ' ' ILE . 48.3 t30 59.78 67.21 0.9 Allowed 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.561 -165.473 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.1 mm-40 -137.83 141.76 40.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.326 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 47.8 mt -68.88 130.79 43.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.536 0.684 . . . . 0.0 110.729 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.84 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 73.2 m -101.63 -49.87 3.88 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.942 -177.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -164.86 164.5 20.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.859 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.418 ' O ' HG13 ' A' ' 133' ' ' ILE . 92.8 mtt180 -96.96 162.24 13.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.21 -36.37 92.3 Favored Glycine 0 C--O 1.226 -0.374 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.242 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -76.46 -1.87 29.28 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 0.0 110.736 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -112.49 -18.13 12.49 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 110.539 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.703 HD13 HD13 ' A' ' 136' ' ' LEU . 96.7 mt -88.82 110.13 20.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.3 0.572 . . . . 0.0 111.247 -175.318 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.656 ' HG3' ' H ' ' A' ' 135' ' ' ASP . 11.2 ptmm? -72.94 -60.07 2.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 174.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.656 ' H ' ' HG3' ' A' ' 134' ' ' LYS . 7.2 m-20 -128.06 116.67 20.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.897 HD11 HD13 ' A' ' 119' ' ' LEU . 2.9 tp -75.28 -27.25 59.31 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.293 0.568 . . . . 0.0 109.553 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -52.55 -56.29 16.28 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.608 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.416 ' HG2' ' HB2' ' A' ' 135' ' ' ASP . 12.1 pt-20 -62.46 -48.65 78.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.033 0.444 . . . . 0.0 111.33 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 138' ' ' GLU . . . -55.95 -54.25 46.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.286 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.81 HD12 HD12 ' A' ' 60' ' ' LEU . 27.0 mt -63.5 -29.68 47.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.727 0.299 . . . . 0.0 111.247 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.623 ' HG3' ' CE1' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -61.8 -43.81 98.11 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 110.018 177.508 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 59.5 mmtt -75.27 -19.2 59.84 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.014 -178.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.577 HD22 ' HB3' ' A' ' 121' ' ' ASN . 40.2 mt -71.82 -40.25 69.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.289 0.566 . . . . 0.0 110.506 175.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.495 HD11 ' HB3' ' A' ' 64' ' ' TYR . 95.4 mt . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.56 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.576 HG21 ' O ' ' A' ' 124' ' ' ASN . 13.5 tt . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 121.264 0.554 . . . . 0.0 111.762 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.453 HG12 HD13 ' A' ' 108' ' ' LEU . 4.4 mp -99.31 130.65 47.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.486 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -75.85 107.51 8.08 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.505 HD11 ' OH ' ' A' ' 109' ' ' TYR . 9.2 mt -89.02 105.37 15.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.686 -172.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.674 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 76.8 mt-30 -100.12 99.95 10.73 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.522 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.8 mt -136.82 153.11 50.89 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 176.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.68 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 90.8 mttt -87.87 136.23 33.05 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.907 0.86 . . . . 0.0 112.103 -173.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.08 165.85 3.99 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.5 -1.682 . . . . 0.0 108.952 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.531 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER -59.43 -30.05 68.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.642 0.734 . . . . 0.0 110.143 179.083 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.521 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 36.3 mtmm -69.05 -8.54 46.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.13 176.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.39 8.06 61.49 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.406 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -97.23 111.98 23.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.7 0.286 . . . . 0.0 111.538 -176.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.68 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 52.7 m -57.93 118.47 5.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.329 0.585 . . . . 0.0 111.225 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.674 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 24.3 mmt180 -93.51 143.87 25.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.648 176.268 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.1 p -122.79 150.82 42.3 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 170.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.459 ' HG ' ' H ' ' A' ' 18' ' ' ILE . 31.4 mt -71.03 -29.9 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.051 0.453 . . . . 0.0 109.974 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 p -61.86 -19.42 62.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.425 175.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.25 -38.34 16.41 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.724 0.773 . . . . 0.0 109.848 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.643 HD23 HG13 ' A' ' 38' ' ' VAL . 11.5 tp -78.55 -1.51 34.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.884 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.561 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 36.1 ttpt -64.77 -10.59 28.83 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.476 0.655 . . . . 0.0 111.068 179.284 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.11 -15.27 60.45 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.917 -0.658 . . . . 0.0 111.734 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -132.2 -179.23 5.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.416 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.495 HG22 ' HB3' ' A' ' 122' ' ' ARG . 99.7 t -84.8 128.9 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 170.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.643 HG13 HD23 ' A' ' 33' ' ' LEU . 43.6 t -106.57 122.77 60.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.292 0.568 . . . . 0.0 112.396 -162.466 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.671 HD11 HD21 ' A' ' 136' ' ' LEU . 13.3 tp -95.08 116.94 29.36 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.93 172.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.627 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 20.7 mm -91.4 106.34 17.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 178.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.551 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.0 t70 -107.53 141.38 39.06 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.73 0.3 . . . . 0.0 111.101 -178.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -128.46 111.84 13.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.699 174.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 t -154.84 175.09 14.18 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.937 0.399 . . . . 0.0 111.006 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.661 HG23 ' HB2' ' A' ' 47' ' ' ASN . 7.9 m -112.98 121.68 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.923 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -75.99 83.83 2.88 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 173.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 179.98 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.684 -167.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.661 ' HB2' HG23 ' A' ' 44' ' ' VAL . 2.1 t-20 -88.5 149.61 23.54 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.387 -168.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.01 -29.97 69.1 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.67 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.7 -25.55 64.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.555 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 m -67.85 -27.49 66.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.14 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.22 -54.59 38.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.63 -38.03 86.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.171 0.51 . . . . 0.0 110.568 178.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.43 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.4 t60 -61.6 -40.91 96.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.711 179.018 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.587 ' HA ' HD12 ' A' ' 57' ' ' LEU . 4.1 t30 -71.33 -34.72 70.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.749 -178.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.58 -41.76 92.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.29 80.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.328 0.585 . . . . 0.0 110.205 176.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 ' HA ' ' A' ' 54' ' ' ASN . 58.8 mt -67.34 -39.67 85.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.663 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.47 ' HD2' ' OD1' ' A' ' 62' ' ' ASN . 3.3 tpp180 -61.31 -24.96 66.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.289 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -74.46 -56.11 5.22 Favored 'General case' 0 CA--C 1.488 -1.436 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.604 HD11 ' HA ' ' A' ' 137' ' ' ASP . 2.1 mm? -56.19 -29.14 60.49 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-N 111.749 -2.478 . . . . 0.0 111.11 177.146 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.409 ' CE2' ' HB2' ' A' ' 91' ' ' PRO . 37.6 t80 -76.38 -52.95 8.87 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.439 -178.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.47 ' OD1' ' HD2' ' A' ' 58' ' ' ARG . 5.9 m-20 -62.48 -22.38 66.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.171 0.51 . . . . 0.0 110.369 -178.341 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -81.19 -62.05 1.77 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.832 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.614 ' HB3' ' CD1' ' A' ' 144' ' ' LEU . 87.9 m-85 -107.76 -8.08 16.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -163.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.524 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.48 -16.89 64.46 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.706 -0.621 . . . . 0.0 111.428 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.8 m -85.56 5.6 30.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.525 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -118.41 14.83 13.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.214 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.17 43.01 3.88 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.832 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.524 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 83.3 t80 -127.91 138.81 52.79 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -177.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -145.24 141.59 28.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 0.0 109.847 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.476 HD12 ' CE3' ' A' ' 92' ' ' TRP . 56.3 mt -99.06 132.79 43.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.941 -174.144 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.515 ' HB2' ' CD2' ' A' ' 33' ' ' LEU . 90.1 t80 -111.02 101.43 9.99 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.067 177.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 40.1 tt0 -102.72 119.11 38.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.15 0.5 . . . . 0.0 111.399 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.466 HD11 HG21 ' A' ' 18' ' ' ILE . 69.9 mt -96.69 127.93 48.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.777 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.0 m -100.37 129.63 46.37 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.401 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.513 HD13 HD12 ' A' ' 114' ' ' LEU . 0.7 OUTLIER -123.86 22.28 8.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.075 0.464 . . . . 0.0 110.461 177.569 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.536 ' HB3' ' HB ' ' A' ' 44' ' ' VAL . 4.6 p-10 -79.09 178.68 7.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.085 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.09 30.84 5.7 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.608 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -135.64 102.49 5.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.639 . . . . 0.0 111.028 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 28.5 tt0 -69.81 -18.33 63.46 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.876 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -70.09 -59.5 2.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.931 -176.069 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -66.32 -36.06 81.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.502 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.531 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 33.2 t90 -57.56 -60.05 4.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.866 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.451 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 31.6 ttmt -61.17 -44.19 97.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.144 -174.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.3 m -62.41 -49.13 76.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.439 -178.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.636 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.1 t -70.82 -45.94 63.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.618 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.457 ' HB1' HD22 ' A' ' 23' ' ' LEU . . . -58.85 -40.58 84.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -175.298 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.33 -28.84 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.294 0.569 . . . . 0.0 110.611 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -96.99 7.26 47.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.306 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 86' ' ' SER . 32.3 mt -100.01 153.59 37.68 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-O 121.177 0.513 . . . . 0.0 111.837 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.637 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.6 Cg_endo -75.17 -45.32 0.28 Allowed 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 123.958 3.106 . . . . 0.0 114.005 -176.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.637 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.0 p90 -94.96 -171.04 2.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.443 . . . . 0.0 112.021 -171.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.2 t -80.05 124.83 38.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.668 -174.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 39.1 m -123.44 109.4 13.8 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.379 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 18.6 m -122.31 161.51 23.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.885 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.423 HH12 ' HB2' ' A' ' 80' ' ' GLU . 59.4 ttp180 -124.47 144.21 50.21 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.054 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.97 163.44 24.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.125 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.0 -32.82 30.39 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -177.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.564 ' HB3' ' HB2' ' A' ' 102' ' ' TYR . 64.9 m-20 -113.75 -12.41 12.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.691 0.281 . . . . 0.0 111.488 -172.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.83 -116.3 5.58 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.207 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.29 -14.34 62.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.064 0.459 . . . . 0.0 111.118 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.564 ' HB2' ' HB3' ' A' ' 99' ' ' ASN . 97.8 m-85 -96.5 19.64 11.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.369 177.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.459 ' HB3' HG13 ' A' ' 106' ' ' ILE . 45.4 t -66.79 138.99 57.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.016 -178.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.583 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.9 m -67.61 -25.84 65.95 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.281 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.52 ' HA ' HD12 ' A' ' 108' ' ' LEU . 98.0 m-85 -61.7 -42.3 98.76 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.203 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.459 HG13 ' HB3' ' A' ' 103' ' ' SER . 67.5 mt -59.94 -32.72 50.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.841 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.2 m -76.81 -33.3 57.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.852 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -62.92 -39.5 94.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.735 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.505 ' OH ' HD11 ' A' ' 18' ' ' ILE . 68.3 m-85 -81.57 -19.42 42.04 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.438 178.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 t30 . . . . . 0 CA--C 1.512 -0.504 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -166.082 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.705 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 80.0 mt . . . . . 0 CA--C 1.534 0.34 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.705 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.96 153.94 96.23 Favored 'Cis proline' 0 C--N 1.355 0.891 0 CA-C-N 120.005 1.037 . . . . 0.0 113.202 0.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 69.1 m -145.13 172.91 12.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.481 -177.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.574 HG12 ' HA3' ' A' ' 130' ' ' GLY . 2.7 p -142.31 158.75 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.035 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.627 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 95.3 m-85 -140.96 161.95 36.63 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 176.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.804 HD13 HD11 ' A' ' 136' ' ' LEU . 17.0 tp -111.05 134.56 52.55 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.175 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.579 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 16.8 t -131.1 119.07 43.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.886 0.374 . . . . 0.0 110.182 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.598 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 3.5 p30 -74.69 164.44 26.58 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.495 ' HB3' HG22 ' A' ' 37' ' ' VAL . 18.0 ptt180 -52.56 -19.19 2.12 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 124.429 1.081 . . . . 0.0 113.795 -171.494 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -84.3 11.49 8.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.068 0.461 . . . . 0.0 109.907 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.576 ' O ' HG21 ' A' ' 15' ' ' ILE . 36.3 t30 57.79 55.35 5.5 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.161 -176.133 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.598 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 31.7 mt-10 -129.06 146.74 50.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.554 178.452 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.3 mt -72.61 112.09 8.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.171 0.51 . . . . 0.0 111.029 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.641 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 9.9 m -74.3 -56.87 4.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.527 177.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.94 170.93 11.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.909 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.567 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 14.7 mmt180 -82.89 152.67 25.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.134 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.574 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -62.28 -34.04 87.97 Favored Glycine 0 CA--C 1.509 -0.337 0 N-CA-C 111.712 -0.555 . . . . 0.0 111.712 177.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 131' ' ' GLU . 17.8 mp0 -64.35 -28.68 69.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.682 -0.759 . . . . 0.0 110.21 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -99.47 -6.32 27.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.752 -171.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 129' ' ' ARG . 85.0 mt -102.76 108.52 24.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.182 -179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.409 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 18.5 pttp -64.17 -48.56 75.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.942 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.409 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 7.3 m-20 -127.77 107.38 9.84 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.804 HD11 HD13 ' A' ' 119' ' ' LEU . 7.3 tp -74.92 -34.6 62.14 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -178.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.604 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.5 t70 -46.93 -58.2 4.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.682 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -62.72 -45.37 93.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.562 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.515 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.7 -52.24 64.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.695 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.661 HG13 ' O ' ' A' ' 136' ' ' LEU . 52.5 mt -57.82 -45.83 87.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 0.0 110.395 177.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 66.7 tttm -52.69 -46.52 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.934 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 34.3 mttm -71.5 -29.37 64.73 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 81.4 mt -65.22 -41.72 94.13 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.787 0.803 . . . . 0.0 109.484 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.614 ' CD1' ' HB3' ' A' ' 64' ' ' TYR . 70.8 mt . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.879 -178.321 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.565 HD12 ' O ' ' A' ' 124' ' ' ASN . 2.4 tt . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.971 0.415 . . . . 0.0 110.869 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.7 mp -107.05 114.08 45.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 171.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.47 108.46 14.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.119 0.485 . . . . 0.0 109.953 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 29' ' ' SER . 7.0 mt -94.93 124.9 47.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.612 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -120.97 99.21 6.37 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.546 -177.553 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.468 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 43.3 mt -131.09 159.1 38.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.9 mttp -90.19 142.57 27.58 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.04 0.448 . . . . 0.0 111.904 -178.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.58 ' OD1' ' HG2' ' A' ' 24' ' ' LYS . 15.9 t70 -75.88 176.89 7.41 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.092 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.92 HD11 ' HB3' ' A' ' 87' ' ' ALA . 3.0 mm? -46.81 -39.77 12.49 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 123.608 0.763 . . . . 0.0 110.889 177.007 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.58 ' HG2' ' OD1' ' A' ' 22' ' ' ASP . 30.6 mmtm -60.08 -48.92 79.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.954 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 9.62 3.97 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.831 -0.907 . . . . 0.0 110.831 -176.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.438 ' OD1' ' HB3' ' A' ' 22' ' ' ASP . 2.2 p30 -103.5 130.72 50.93 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.8 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.602 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 42.2 m -70.08 128.95 38.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.206 0.527 . . . . 0.0 111.313 -178.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.546 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 15.3 mmm180 -112.18 132.99 54.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.984 175.289 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.7 p -121.53 163.49 18.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.785 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.474 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 73.6 mt -76.11 -28.78 57.63 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 177.443 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 p -67.14 -14.58 63.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.371 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.02 -32.01 19.02 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.533 ' HB3' HG21 ' A' ' 38' ' ' VAL . 4.0 mp -90.71 10.04 27.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.905 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.665 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.4 ttmm -72.86 128.25 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.137 0.494 . . . . 0.0 110.372 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.07 -20.38 9.17 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 -172.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -109.22 168.71 9.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.922 -0.639 . . . . 0.0 110.376 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.833 HG23 ' HD2' ' A' ' 122' ' ' ARG . 80.6 t -91.34 118.58 36.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 169.036 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.732 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 95.2 t -111.5 131.38 62.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 121.716 0.769 . . . . 0.0 112.129 -169.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.9 tt -92.27 110.0 21.39 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.159 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.648 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 3.0 mp -84.19 106.49 14.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 175.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.624 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 26.1 t0 -98.55 144.74 27.54 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.601 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.539 ' HB3' HD21 ' A' ' 114' ' ' LEU . 21.7 m-85 -133.41 105.85 7.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 175.313 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.9 t -154.18 155.82 35.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.148 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.511 HG13 HD23 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -96.79 118.89 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.139 172.721 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.402 ' HD1' ' OG ' ' A' ' 75' ' ' SER . 17.7 m-85 -66.71 87.77 0.13 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 170.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 177.82 -35.51 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.102 -1.408 . . . . 0.0 109.157 -168.337 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -89.01 142.3 27.76 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.207 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.42 -29.81 64.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.961 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.4 mmm -64.32 -20.13 65.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.602 0.239 . . . . 0.0 111.337 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.4 t -64.99 -27.16 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.31 -50.17 61.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.388 . . . . 0.0 110.598 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.36 -29.41 69.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.418 0.627 . . . . 0.0 110.314 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.564 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 62.5 t60 -68.08 -47.38 68.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.5 176.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.577 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.2 m-20 -65.37 -27.14 68.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.985 178.469 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.76 -53.68 54.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.407 0.622 . . . . 0.0 109.886 174.564 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.95 74.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.662 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 54' ' ' ASN . 93.2 mt -63.92 -39.57 94.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.882 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -64.23 -26.04 68.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.728 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 5.1 tt0 -78.02 -50.46 12.06 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -177.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 63' ' ' LYS . 19.0 mt -53.72 -34.47 58.97 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 112.448 -2.16 . . . . 0.0 111.179 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.462 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 35.5 t80 -67.67 -45.76 74.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.275 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -68.04 -21.28 65.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.998 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.561 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 60.7 mttm -85.49 -61.15 1.83 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.679 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.583 ' HB3' HD11 ' A' ' 144' ' ' LEU . 66.8 m-85 -106.27 -14.8 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -163.318 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.548 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.35 169.7 11.78 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.92 -177.454 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 24.7 m 72.82 -35.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.386 0.675 . . . . 0.0 111.46 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 65' ' ' ALA . 47.6 mt-30 -81.87 11.03 5.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 110.944 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.4 47.53 1.3 Allowed Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.669 -176.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.548 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 64.5 t80 -141.43 134.65 29.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -143.55 150.05 38.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.499 HD12 ' CE3' ' A' ' 92' ' ' TRP . 58.5 mt -110.36 127.38 67.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.075 0.464 . . . . 0.0 110.299 -177.164 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.487 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.8 t80 -119.56 100.59 7.37 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.495 -176.179 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.624 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 44.1 mt-30 -93.29 117.01 29.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.234 -175.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.47 HD11 ' CE2' ' A' ' 72' ' ' TYR . 16.7 mm -86.58 113.96 25.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.651 171.542 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.402 ' OG ' ' HD1' ' A' ' 45' ' ' TYR . 42.2 t -105.11 111.6 24.42 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.334 0.588 . . . . 0.0 110.781 179.136 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.521 HD13 ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -102.74 39.3 1.55 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.548 177.047 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.482 ' HA ' HG12 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -50.31 -73.77 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.289 -1.323 . . . . 0.0 113.621 -173.697 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 124.94 -7.07 8.24 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 111.107 -0.797 . . . . 0.0 111.107 -172.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -142.34 119.12 11.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 20.9 tt0 -68.08 -41.74 81.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.955 -173.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 -79.9 -24.33 41.2 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -168.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -70.95 -48.83 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.569 ' CZ2' HD13 ' A' ' 23' ' ' LEU . 12.5 t90 -61.83 -47.07 86.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.891 176.238 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.915 ' HA ' HD12 ' A' ' 23' ' ' LEU . 60.3 tttt -62.13 -44.27 97.01 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.4 p -69.75 -41.09 75.67 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.91 0.386 . . . . 0.0 111.397 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.7 p -76.7 -42.79 40.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.857 -176.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.92 ' HB3' HD11 ' A' ' 23' ' ' LEU . . . -79.57 -24.63 41.96 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -171.747 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.4 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 24.6 t70 -71.8 -8.78 56.34 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.506 0.67 . . . . 0.0 110.442 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -101.8 9.94 40.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.119 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.862 ' HG ' ' O ' ' A' ' 87' ' ' ALA . 3.7 pp -98.44 158.2 33.03 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.968 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.764 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 32.5 Cg_endo -85.03 -3.06 9.66 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 124.062 3.174 . . . . 0.0 114.693 -172.06 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.835 ' CD1' HD13 ' A' ' 90' ' ' LEU . 2.4 p90 -122.55 -153.64 0.56 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.546 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 83.9 t -103.28 134.3 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -177.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.463 ' HB3' HD21 ' A' ' 23' ' ' LEU . 39.1 t -137.93 112.86 9.06 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.45 0.643 . . . . 0.0 109.539 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.468 ' CG2' ' HB2' ' A' ' 20' ' ' LEU . 27.4 m -114.6 148.07 17.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.896 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.478 ' HD2' ' CE3' ' A' ' 83' ' ' TRP . 36.1 ttt180 -100.24 137.49 38.61 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.92 0.391 . . . . 0.0 111.215 -174.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -87.09 146.01 26.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.265 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.64 -28.36 30.77 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 4.8 m-20 -91.53 -13.83 31.42 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -171.128 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 54.84 72.75 0.5 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.451 -0.404 . . . . 0.0 113.357 176.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.502 ' N ' ' HB2' ' A' ' 76' ' ' LEU . . . 78.2 -15.81 0.72 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.721 0.808 . . . . 0.0 111.858 177.17 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.54 25.24 5.89 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.443 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.9 OUTLIER -66.47 135.13 53.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.116 -176.393 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.616 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 26.2 m -55.65 -36.3 66.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.517 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.55 -46.12 84.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.191 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.443 HG13 ' HB2' ' A' ' 103' ' ' SER . 65.8 mt -57.54 -43.48 83.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.753 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -67.59 -32.25 72.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.103 176.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 104' ' ' SER . 84.9 mt -65.7 -39.71 91.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.278 -179.465 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.423 ' O ' ' CB ' ' A' ' 110' ' ' ASN . 65.2 m-85 -77.12 -50.96 11.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.558 175.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.423 ' CB ' ' O ' ' A' ' 109' ' ' TYR . 8.6 t30 . . . . . 0 N--CA 1.478 0.941 0 O-C-N 125.525 1.766 . . . . 0.0 108.226 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.539 HD21 ' HB3' ' A' ' 42' ' ' PHE . 2.4 mp . . . . . 0 C--O 1.236 0.39 0 CA-C-O 120.556 0.217 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.401 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 4.9 Cg_exo -73.78 159.03 98.16 Favored 'Cis proline' 0 C--N 1.35 0.646 0 C-N-CA 123.249 -1.563 . . . . 0.0 112.053 0.149 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.8 m -145.81 175.76 10.17 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.567 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.9 p -143.11 155.12 17.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.648 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 93.3 m-85 -133.8 155.63 49.46 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.983 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 5.1 tp -118.41 143.93 46.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.318 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.735 HG12 ' HA ' ' A' ' 126' ' ' LEU . 14.5 m -138.99 140.15 39.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.078 0.466 . . . . 0.0 110.115 167.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.576 ' HB3' HD22 ' A' ' 143' ' ' LEU . 1.2 p30 -89.49 178.29 6.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.859 -176.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.833 ' HD2' HG23 ' A' ' 37' ' ' VAL . 9.8 mmm180 -38.14 -48.2 1.22 Allowed 'General case' 0 N--CA 1.481 1.115 0 O-C-N 124.808 1.318 . . . . 0.0 113.813 -171.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.49 9.5 1.04 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.453 -176.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.665 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 1.6 t-20 54.28 57.95 5.4 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 123.594 0.758 . . . . 0.0 110.305 -171.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -128.09 140.15 52.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.716 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.735 ' HA ' HG12 ' A' ' 120' ' ' VAL . 3.8 tt -62.12 121.02 12.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.681 0.753 . . . . 0.0 111.295 -170.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.983 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 68.8 m -84.92 -54.58 4.57 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.436 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.497 ' HB1' ' OD1' ' A' ' 132' ' ' ASN . . . -168.98 173.6 6.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 -174.079 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.473 ' O ' HG13 ' A' ' 133' ' ' ILE . 89.7 mtt180 -110.58 158.83 18.14 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.805 -178.664 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.83 -14.99 32.71 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.06 173.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.25 -28.03 62.88 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 122.469 0.308 . . . . 0.0 111.033 176.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.497 ' OD1' ' HB1' ' A' ' 128' ' ' ALA . 24.6 p30 -127.57 -7.12 5.72 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.725 HG21 ' HG ' ' A' ' 136' ' ' LEU . 89.8 mt -78.8 108.63 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.564 ' HD2' ' H ' ' A' ' 134' ' ' LYS . 0.1 OUTLIER -58.42 -51.11 71.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.797 0.808 . . . . 0.0 110.009 178.122 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.557 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 9.8 t70 -154.38 124.91 6.99 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.137 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.725 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.7 mp -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.74 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -48.55 -52.69 21.46 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 123.051 0.219 . . . . 0.0 111.409 174.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -69.66 -38.79 77.22 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.321 0.581 . . . . 0.0 111.542 -179.156 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.649 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -62.81 -53.2 57.97 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.854 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.549 HG13 ' O ' ' A' ' 136' ' ' LEU . 41.7 mt -62.0 -32.03 53.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.271 0.558 . . . . 0.0 110.397 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -58.8 -43.08 90.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.412 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? -84.65 -18.84 34.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.203 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 30.8 mt -73.18 -41.84 63.4 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.25 178.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.583 HD11 ' HB3' ' A' ' 64' ' ' TYR . 21.1 mt . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 121.434 0.635 . . . . 0.0 109.72 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.805 HG13 ' HG ' ' A' ' 126' ' ' LEU . 12.1 tt . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.488 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.6 mp -101.5 109.03 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 172.08 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.437 ' HA ' HD12 ' A' ' 30' ' ' LEU . 25.8 t0 -73.51 131.97 42.36 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.434 HG23 ' CZ ' ' A' ' 105' ' ' TYR . 7.3 mt -113.29 111.58 36.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.138 -175.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.552 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.2 mp0 -98.87 100.16 11.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.296 178.399 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.95 154.39 51.12 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 89.7 mttt -85.34 143.19 28.81 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.925 0.393 . . . . 0.0 110.854 -175.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.4 p-10 -76.68 -167.13 0.76 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.929 -178.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.651 HD11 ' HG3' ' A' ' 84' ' ' LYS . 36.9 tp -56.67 -36.32 69.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -79.66 -33.52 41.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.675 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.457 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 116.49 20.24 5.13 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.065 -177.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -95.92 114.87 26.63 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 175.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.7 m -61.99 115.49 4.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.357 0.599 . . . . 0.0 111.182 178.024 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.552 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 18.8 mmm180 -92.27 142.1 27.84 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.501 175.554 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.5 p -120.1 159.5 24.7 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 172.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 17' ' ' ASP . 71.7 mt -80.91 -28.79 35.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.689 0.281 . . . . 0.0 111.229 -177.614 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.87 0.64 8.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.97 0.414 . . . . 0.0 111.241 175.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -83.45 -50.34 8.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.667 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.567 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -98.73 26.02 6.02 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.854 0.835 . . . . 0.0 110.277 -176.839 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.622 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 30.3 ttpt -59.47 -26.57 65.35 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 113.976 -1.465 . . . . 0.0 112.514 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -56.5 -21.72 35.8 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 116.279 -0.419 . . . . 0.0 113.866 -176.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.615 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -138.41 -169.66 2.64 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 116.859 0.329 . . . . 0.0 110.522 178.483 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.668 HG11 ' HB3' ' A' ' 143' ' ' LEU . 27.6 m -82.52 143.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 -176.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.551 HG22 ' HG ' ' A' ' 33' ' ' LEU . 21.5 t -119.98 137.89 52.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.975 -173.426 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.667 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.7 tp -102.66 106.2 16.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.969 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.636 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.2 mm -84.74 106.47 14.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.558 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 5.1 t70 -108.42 135.08 50.31 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.705 0.288 . . . . 0.0 111.032 -175.719 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.539 ' HB3' HD11 ' A' ' 76' ' ' LEU . 59.8 m-85 -123.13 99.92 6.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.068 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.565 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 15.8 m -138.81 149.66 45.19 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.018 0.437 . . . . 0.0 111.847 -170.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 47' ' ' ASN . 13.7 m -96.13 115.71 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 121.178 0.513 . . . . 0.0 110.755 176.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.536 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 36.7 m-85 -78.73 85.4 4.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.576 0.703 . . . . 0.0 109.477 176.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 178.25 -34.69 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.352 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.547 ' HB2' HG23 ' A' ' 44' ' ' VAL . 2.7 t-20 -84.04 163.45 19.89 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.698 -171.234 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.83 -30.4 40.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.339 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.6 tpt -62.5 -26.53 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.738 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 m -60.79 -34.13 74.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.141 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.64 -52.22 65.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.633 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.83 81.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.856 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.49 ' HE2' ' CG ' ' A' ' 41' ' ' ASP . 73.5 t60 -61.97 -51.57 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.81 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.572 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.0 m-20 -75.01 -18.01 60.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.589 -177.105 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 1.8 tm? -69.03 -51.34 40.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.02 -39.17 84.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.502 178.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.572 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.2 mt -60.65 -38.95 86.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.086 174.168 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 7.5 tpp180 -62.83 -27.83 69.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.563 179.128 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -78.13 -51.01 10.9 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.714 HD12 HD12 ' A' ' 140' ' ' ILE . 2.9 mm? -56.09 -32.27 63.99 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 112.735 -2.03 . . . . 0.0 111.07 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.503 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 30.5 t80 -70.21 -49.12 53.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.084 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -64.03 -21.41 66.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.654 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -84.05 -61.74 1.74 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.063 -177.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.515 ' HB3' HD11 ' A' ' 144' ' ' LEU . 84.9 m-85 -113.84 -18.2 11.86 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -166.023 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.47 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.57 161.5 29.45 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.004 -176.232 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.5 m 77.73 -34.76 0.2 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.529 0.732 . . . . 0.0 111.543 -177.089 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -85.24 11.04 10.79 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.068 177.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.612 ' O ' ' HB2' ' A' ' 36' ' ' LYS . . . 121.47 27.53 1.78 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.35 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.667 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 56.2 t80 -134.98 130.06 35.17 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 176.105 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.615 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 3.0 tt0 -133.3 156.26 47.92 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.261 178.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.477 HD12 ' CE3' ' A' ' 92' ' ' TRP . 54.2 mt -120.78 131.6 72.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.391 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.498 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 66.2 t80 -121.17 101.02 7.39 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.09 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.558 ' HG3' ' HB3' ' A' ' 41' ' ' ASP . 7.3 tt0 -105.91 145.76 30.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.014 0.435 . . . . 0.0 111.052 -176.317 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.423 HD11 ' HE2' ' A' ' 72' ' ' TYR . 46.5 mt -126.51 127.58 70.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.959 -177.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.536 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 2.6 p -85.34 121.81 28.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.962 0.41 . . . . 0.0 110.955 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.58 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 12.1 mt -110.39 9.07 23.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.387 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.497 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.0 OUTLIER -68.66 -68.71 0.38 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.05 -175.808 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.64 23.24 6.02 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -174.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -134.57 98.85 4.18 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.523 ' HG2' ' CE3' ' A' ' 83' ' ' TRP . 25.8 mt-10 -75.35 -14.47 60.48 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.677 -176.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -50.87 66.78 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.002 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -81.78 -30.48 32.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.225 -177.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.545 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 42.6 t90 -66.16 -52.0 52.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.097 175.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.651 ' HG3' HD11 ' A' ' 23' ' ' LEU . 19.1 ttmm -64.17 -43.47 95.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.934 -173.411 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.9 p -65.05 -43.24 92.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.666 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.428 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 38.1 t -74.46 -37.13 63.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.532 -178.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.566 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -69.91 -29.07 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -174.865 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.44 -23.02 66.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.305 0.574 . . . . 0.0 110.764 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -92.38 -8.18 45.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.83 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 86' ' ' SER . 34.8 mt -76.75 146.4 76.28 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.688 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 20.0 Cg_endo -91.25 -17.06 1.24 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 124.423 3.415 . . . . 0.0 113.523 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.688 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.4 p90 -115.93 -170.32 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.7 0.286 . . . . 0.0 110.94 -175.077 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.457 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 60.3 t -81.24 122.27 36.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.072 -176.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 49.8 t -125.8 109.31 12.39 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.957 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.489 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 17.2 m -117.63 158.75 18.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.892 -178.053 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.463 ' HA ' ' OG ' ' A' ' 75' ' ' SER . 19.0 ttp180 -107.91 136.23 47.97 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.139 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -80.77 155.54 26.63 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.55 -20.46 36.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.763 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.513 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 3.3 m-80 -122.19 -12.94 8.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.579 -173.393 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.58 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 70.97 -129.89 18.9 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.619 -0.8 . . . . 0.0 111.887 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.26 -5.63 29.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.851 0.357 . . . . 0.0 111.379 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -102.53 12.72 36.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.241 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.533 ' HB3' HG13 ' A' ' 106' ' ' ILE . 34.7 t -62.97 134.66 56.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.055 -177.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.505 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 8.0 m -61.26 -26.99 68.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.741 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.434 ' CZ ' HG23 ' A' ' 18' ' ' ILE . 64.1 m-85 -60.5 -45.09 95.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.611 178.283 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.533 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.6 mt -61.15 -36.0 69.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.508 -177.464 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.6 m -68.16 -35.64 78.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.724 178.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.5 mt -65.06 -35.25 80.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.439 -178.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.422 ' OH ' HD11 ' A' ' 18' ' ' ILE . 93.4 m-85 -74.24 -20.43 60.17 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.145 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 . . . . . 0 CA--C 1.52 -0.194 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -167.324 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.659 HD23 ' HB2' ' A' ' 116' ' ' SER . 64.9 mt . . . . . 0 C--O 1.234 0.246 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.565 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 20.4 Cg_exo -67.4 147.24 77.81 Favored 'Cis proline' 0 C--N 1.352 0.723 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.143 0.458 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.659 ' HB2' HD23 ' A' ' 114' ' ' LEU . 8.8 m -142.22 177.94 7.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.765 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.424 HG11 HD21 ' A' ' 136' ' ' LEU . 4.5 p -135.44 162.13 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.844 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.636 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 63.9 m-85 -138.78 160.22 40.21 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 175.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.846 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -110.44 139.0 46.08 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.473 -174.201 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.601 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 52.9 t -127.75 118.83 50.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.947 176.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.433 ' OD1' ' HB2' ' A' ' 125' ' ' GLU . 4.1 p-10 -76.75 162.63 27.52 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.987 176.566 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -69.78 27.82 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -167.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 121' ' ' ASN . 16.8 m120 -123.84 14.44 9.29 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 174.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.622 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 48.0 t30 53.24 61.66 3.04 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.168 -169.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 68.6 mt-10 -130.88 150.74 51.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.175 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.805 ' HG ' HG13 ' A' ' 15' ' ' ILE . 24.7 mt -72.37 119.67 16.91 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.125 0.488 . . . . 0.0 110.103 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.846 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 35.5 m -83.42 -51.26 7.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.344 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -170.02 172.78 6.31 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.02 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.498 ' O ' HG13 ' A' ' 133' ' ' ILE . 82.0 mtm180 -103.16 158.39 16.34 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.404 -176.108 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.4 -35.82 73.78 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 121.565 -0.35 . . . . 0.0 112.892 -175.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.489 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.5 pm0 -77.61 -7.08 55.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.117 178.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -105.0 -20.18 13.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.732 HG21 ' HG ' ' A' ' 136' ' ' LEU . 60.5 mt -97.49 138.86 21.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.375 -176.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.59 1.07 4.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.088 0.471 . . . . 0.0 110.032 177.28 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -144.87 48.93 1.3 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.51 -168.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.732 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.9 mp -56.43 -38.91 72.24 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -176.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.41 -53.33 57.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.39 . . . . 0.0 110.031 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.517 ' HA ' ' HE2' ' A' ' 141' ' ' LYS . 66.0 mm-40 -62.72 -39.56 94.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.942 175.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 1.042 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.59 -56.9 16.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.648 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.714 HD12 HD12 ' A' ' 60' ' ' LEU . 52.0 mt -56.33 -42.37 73.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.378 0.609 . . . . 0.0 110.492 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.5 ttpt -60.41 -42.43 95.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.447 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 1.042 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 36.5 pttt -80.24 -23.45 40.85 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 120.659 0.266 . . . . 0.0 111.036 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.668 ' HB3' HG11 ' A' ' 37' ' ' VAL . 82.5 mt -70.72 -40.54 72.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.715 176.321 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 90.9 mt . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.921 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.4 tp . . . . . 0 N--CA 1.446 -0.671 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.496 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -101.16 105.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 176.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -76.11 111.07 11.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.257 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.4 HG22 ' HG ' ' A' ' 20' ' ' LEU . 13.2 mt -108.4 130.44 61.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.945 -177.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.541 ' HG3' ' HB3' ' A' ' 29' ' ' SER . 12.8 mp0 -111.56 100.7 9.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.514 -178.679 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.4 ' HG ' HG22 ' A' ' 18' ' ' ILE . 50.4 mt -130.06 154.64 47.23 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.509 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 92.8 mttt -88.79 146.57 24.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.804 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.747 ' OD2' ' HG2' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -85.45 -172.47 4.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 179.777 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.54 HD11 ' HG3' ' A' ' 84' ' ' LYS . 55.3 tp -51.43 -36.51 44.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.931 177.005 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.747 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 25.9 mmtm -72.79 -43.13 63.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.473 0.654 . . . . 0.0 110.012 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 125.62 11.16 4.17 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.665 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.491 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 20.5 m120 -83.43 113.33 20.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 178.111 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.509 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 16.1 m -64.55 107.35 1.37 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.118 0.485 . . . . 0.0 110.02 173.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.519 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 17.6 mmm180 -93.02 138.57 31.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.163 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.541 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 2.9 p -118.29 154.18 32.72 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 16' ' ' ILE . 82.3 mt -77.37 -30.98 54.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.853 0.358 . . . . 0.0 110.738 -176.262 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.41 ' HA ' ' ND2' ' A' ' 124' ' ' ASN . 12.5 t -74.89 0.24 16.27 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.141 0.496 . . . . 0.0 110.67 178.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -87.97 -51.23 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.446 ' O ' ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -85.17 12.38 8.02 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 122.057 0.932 . . . . 0.0 110.644 -176.455 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.45 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 25.9 ttpp -56.27 124.08 16.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.728 169.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.71 -40.12 1.17 Allowed Glycine 0 CA--C 1.495 -1.217 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -172.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HB2' ' C ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -119.27 173.67 6.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 172.592 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.641 HG23 ' HD1' ' A' ' 69' ' ' PHE . 17.1 m -75.87 136.37 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.947 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.416 HG22 ' HG ' ' A' ' 33' ' ' LEU . 33.0 t -116.76 123.69 71.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.94 -171.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.626 ' HB3' HG23 ' A' ' 71' ' ' ILE . 10.5 tp -87.17 112.7 22.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.751 175.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.612 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.3 mm -87.36 105.08 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 18.1 t70 -109.65 134.88 51.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.761 0.315 . . . . 0.0 111.033 -175.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.549 ' HB3' HD13 ' A' ' 114' ' ' LEU . 61.7 m-85 -122.35 99.1 6.24 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.552 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.899 ' O ' ' HA ' ' A' ' 75' ' ' SER . 20.6 m -139.71 143.68 37.17 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.107 0.48 . . . . 0.0 111.5 -169.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.695 HG13 ' HB2' ' A' ' 47' ' ' ASN . 3.4 p -96.81 120.96 46.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 O-C-N 121.978 -0.451 . . . . 0.0 110.138 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.599 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 48.3 m-85 -77.22 79.38 3.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.749 0.785 . . . . 0.0 109.46 176.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -178.75 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.884 -1.507 . . . . 0.0 109.112 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.695 ' HB2' HG13 ' A' ' 44' ' ' VAL . 38.5 t-20 -65.41 140.43 58.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.627 -179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.89 -35.43 80.63 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.484 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -67.85 -19.89 65.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.065 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 m -68.03 -29.09 67.99 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.138 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.6 -55.58 16.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.832 0.349 . . . . 0.0 110.851 -178.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.07 86.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 0.0 110.711 178.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.623 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 72.1 t60 -61.58 -38.99 89.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.952 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.49 ' HA ' HD12 ' A' ' 57' ' ' LEU . 21.7 t-20 -68.73 -30.33 68.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.544 0.211 . . . . 0.0 110.712 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tt -69.74 -41.84 74.73 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.27 80.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.388 176.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 76.6 mt -67.98 -39.44 83.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.481 176.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 58' ' ' ARG . 2.0 tpp180 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.13 -52.96 12.28 Favored 'General case' 0 CA--C 1.493 -1.237 0 CA-C-O 122.743 1.258 . . . . 0.0 108.08 -173.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.86 HD12 HD12 ' A' ' 140' ' ' ILE . 2.3 mm? -55.76 -31.7 62.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 112.219 -2.264 . . . . 0.0 110.888 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -75.25 -50.12 17.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.894 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -61.15 -22.03 64.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.529 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -81.67 -60.74 2.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.077 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -104.66 -7.69 19.43 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -166.322 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.544 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.88 165.8 16.88 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.491 -0.483 . . . . 0.0 111.169 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 56.9 m 70.89 -10.95 0.69 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.779 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -105.18 3.44 30.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.956 0.408 . . . . 0.0 110.729 179.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.546 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 114.3 45.73 0.66 Allowed Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.641 ' HD1' HG23 ' A' ' 37' ' ' VAL . 83.1 t80 -138.25 130.43 28.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.874 0.369 . . . . 0.0 110.822 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.44 ' HB3' ' HD3' ' A' ' 36' ' ' LYS . 22.4 tt0 -144.95 157.32 44.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.006 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.626 HG23 ' HB3' ' A' ' 39' ' ' LEU . 58.2 mt -127.45 136.43 60.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.305 -171.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.558 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 50.0 t80 -123.52 102.1 7.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.499 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.593 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.1 mt-30 -93.74 141.97 27.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 111.578 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.5 mt -122.26 122.17 65.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.038 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.899 ' HA ' ' O ' ' A' ' 43' ' ' THR . 78.7 p -99.73 142.01 31.78 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -175.308 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.747 HD11 HD12 ' A' ' 114' ' ' LEU . 81.5 mt -110.71 31.54 5.91 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.249 0.547 . . . . 0.0 109.565 172.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.558 ' HA ' HG23 ' A' ' 44' ' ' VAL . 5.3 p-10 -73.1 144.64 46.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.184 -173.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -108.31 16.7 34.97 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 164.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -125.69 94.6 4.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.151 -1.024 . . . . 0.0 109.278 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.416 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 32.0 tt0 -72.89 -27.06 61.66 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.227 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 -72.68 -32.85 66.12 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.766 -174.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -79.09 -40.53 30.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.535 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 39.9 t90 -61.11 -48.92 79.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.632 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.54 ' HG3' HD11 ' A' ' 23' ' ' LEU . 35.9 ttmt -62.46 -44.36 96.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.887 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 p -75.19 -34.25 61.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.359 . . . . 0.0 111.633 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.641 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 21.8 t -73.04 -44.99 60.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.449 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -67.55 -24.52 65.54 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.208 -178.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -63.39 -38.41 91.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.43 0.633 . . . . 0.0 109.709 176.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -93.99 11.41 29.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.969 -177.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 86' ' ' SER . 20.1 mt -97.64 133.68 23.29 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-O 121.535 0.683 . . . . 0.0 112.294 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.648 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 57.7 Cg_endo -80.45 -31.55 1.55 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 124.312 3.341 . . . . 0.0 113.071 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.648 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.8 p90 -100.77 -167.0 1.37 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.967 -173.817 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.558 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 54.1 t -81.68 132.72 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.782 -175.46 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.449 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -136.65 100.04 4.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.062 179.4 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.624 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 14.5 m -114.87 151.25 16.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.474 -175.336 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -107.88 137.44 45.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 0.0 111.882 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -92.14 135.43 33.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.036 174.466 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.77 -4.34 57.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -94.6 -14.78 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.721 -174.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 49.36 66.5 2.2 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.838 174.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.565 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 77.55 -5.17 2.18 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.414 0.685 . . . . 0.0 112.845 175.291 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -101.01 12.91 36.8 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.467 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.7 OUTLIER -61.96 126.59 27.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.89 -175.77 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.6 m -55.41 -28.88 56.96 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.372 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -61.3 -38.93 88.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.842 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.467 HG13 ' HB2' ' A' ' 103' ' ' SER . 71.9 mt -59.66 -35.06 57.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.839 -178.677 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.7 m -73.86 -27.6 61.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.929 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.84 -37.81 67.31 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.089 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -77.34 -8.51 57.78 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 121.135 -0.226 . . . . 0.0 110.598 178.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 38.4 t-20 . . . . . 0 CA--C 1.516 -0.355 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -169.653 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.747 HD12 HD11 ' A' ' 76' ' ' LEU . 72.1 mt . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.671 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 14.2 Cg_exo -69.35 159.44 88.4 Favored 'Cis proline' 0 C--N 1.354 0.833 0 C-N-CA 124.597 -1.001 . . . . 0.0 113.802 1.207 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 67.9 m -153.07 174.41 14.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.739 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.9 p -142.15 155.71 19.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.612 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.3 m-85 -136.02 161.88 34.44 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.792 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.2 tp -111.76 133.48 53.96 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 4.2 t -131.29 128.41 61.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.854 0.359 . . . . 0.0 110.322 174.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.558 ' HB3' HD22 ' A' ' 143' ' ' LEU . 2.7 p-10 -90.79 174.6 7.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.245 178.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -54.17 -23.23 13.58 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -166.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ASN . . . . . 0.54 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 28.0 m-20 -83.82 9.86 10.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.649 0.261 . . . . 0.0 110.513 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.45 ' HB2' ' HD3' ' A' ' 34' ' ' LYS . 28.3 t30 64.79 35.74 8.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.978 -174.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.54 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 43.9 mt-10 -109.48 138.04 46.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.025 -176.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.85 112.8 3.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.675 0.75 . . . . 0.0 110.85 176.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.792 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 45.7 m -78.01 -55.65 5.12 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.621 178.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.22 14.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.956 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.644 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 0.2 OUTLIER -99.31 159.37 15.05 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.218 178.649 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -55.69 -46.18 83.05 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 121.613 -0.327 . . . . 0.0 113.64 -175.401 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' GLU . . . . . 0.644 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.0 OUTLIER -71.78 -29.66 64.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.261 0.553 . . . . 0.0 110.018 179.765 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.459 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -68.33 -39.53 81.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.613 177.318 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.826 HG21 ' HG ' ' A' ' 136' ' ' LEU . 75.3 mt -70.71 147.36 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.535 178.33 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HE3' ' HB3' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -140.71 108.5 5.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 171.904 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.488 ' OD1' ' HB3' ' A' ' 137' ' ' ASP . 15.7 t70 67.7 102.31 0.05 OUTLIER 'General case' 0 C--O 1.233 0.202 0 O-C-N 124.432 1.083 . . . . 0.0 109.867 -168.423 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.826 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.8 mp -75.13 -22.24 58.31 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.69 -177.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.488 ' HB3' ' OD1' ' A' ' 135' ' ' ASP . 9.7 t70 -52.73 -53.87 41.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.18 175.578 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.654 ' HB3' ' HE2' ' A' ' 142' ' ' LYS . 33.1 mm-40 -56.98 -50.4 72.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.331 173.341 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -53.89 -54.27 41.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.174 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.86 HD12 HD12 ' A' ' 60' ' ' LEU . 31.0 mt -67.11 -33.54 63.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.043 0.449 . . . . 0.0 110.928 -177.418 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -65.21 -32.78 74.63 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.402 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.654 ' HE2' ' HB3' ' A' ' 138' ' ' GLU . 54.1 mttm -80.46 -20.45 43.73 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.95 177.598 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.558 HD22 ' HB3' ' A' ' 121' ' ' ASN . 65.5 mt -73.6 -43.05 60.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.901 177.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 91.9 mt . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.575 178.493 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.45 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 10.3 tt . . . . . 0 CA--C 1.535 0.38 0 CA-C-O 121.042 0.449 . . . . 0.0 111.913 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.674 ' H ' HD12 ' A' ' 16' ' ' ILE . 3.9 mp -74.75 103.79 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 173.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.79 108.17 9.63 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.1 mt -100.76 116.92 45.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.119 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.578 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 78.7 mt-30 -107.85 101.48 10.76 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.192 0.52 . . . . 0.0 110.82 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.838 ' HB2' HG11 ' A' ' 95' ' ' VAL . 29.6 mt -138.87 162.1 35.65 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.536 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 51.8 mttm -94.25 150.06 20.65 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.344 0.592 . . . . 0.0 111.435 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.57 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -81.24 -170.26 2.66 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.558 177.213 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.645 HD11 ' HE2' ' A' ' 84' ' ' LYS . 44.7 tp -54.82 -39.69 68.78 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.723 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 52.8 mttp -78.04 -26.95 48.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.445 -176.469 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 114.54 11.49 11.61 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.114 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.482 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 36.4 m-80 -82.79 110.45 17.83 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.536 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.3 m -68.27 113.55 5.98 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.521 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.6 mmm180 -103.42 139.58 38.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.037 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.578 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 82.4 p -120.48 160.3 23.42 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.585 HD12 ' O ' ' A' ' 16' ' ' ILE . 63.4 mt -80.55 -25.29 38.7 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.745 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.7 p -66.49 -20.17 65.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 173.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -79.28 -40.86 29.44 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 122.232 1.015 . . . . 0.0 108.476 175.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 tp -78.29 6.26 8.64 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.824 -1.534 . . . . 0.0 110.879 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.729 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.5 ttmm -73.96 114.96 12.85 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.344 -177.03 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.61 -25.41 2.29 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -173.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.653 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -117.77 168.24 10.64 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.438 175.75 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.756 HG23 ' HD1' ' A' ' 69' ' ' PHE . 29.4 m -82.92 124.58 39.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 173.205 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.68 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 72.3 t -113.05 136.92 47.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.565 0.698 . . . . 0.0 112.101 -168.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 39' ' ' LEU . 9.4 tp -98.99 119.18 37.33 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.624 177.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.407 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 0.2 OUTLIER -97.12 104.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.903 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -107.68 135.0 49.84 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.613 ' O ' ' HA ' ' A' ' 115' ' ' PRO . 82.9 m-85 -119.04 101.62 8.16 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 75' ' ' SER . 1.1 t -128.63 -178.21 4.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.186 -172.221 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.67 HG13 ' HB3' ' A' ' 47' ' ' ASN . 0.4 OUTLIER -135.79 117.6 20.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.265 177.456 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.501 ' OH ' HD11 ' A' ' 90' ' ' LEU . 32.0 m-85 -78.64 80.07 5.03 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.546 0.689 . . . . 0.0 110.689 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -179.67 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.757 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.67 ' HB3' HG13 ' A' ' 44' ' ' VAL . 4.6 t30 -77.51 132.71 38.51 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.562 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.05 -26.68 68.36 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.475 -173.234 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.91 -32.5 72.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.304 0.573 . . . . 0.0 109.603 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.3 m -68.22 -27.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.733 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.1 43.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.743 0.306 . . . . 0.0 111.042 -177.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.87 -34.09 76.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.48 . . . . 0.0 110.796 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.45 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 76.5 t60 -64.31 -38.75 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.578 ' HA ' HD12 ' A' ' 57' ' ' LEU . 6.2 m-20 -70.89 -18.83 62.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.615 -179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.2 tt -77.18 -41.75 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.025 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.76 82.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.373 0.606 . . . . 0.0 109.814 175.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.578 HD12 ' HA ' ' A' ' 54' ' ' ASN . 82.3 mt -65.36 -38.6 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.684 176.318 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.413 ' HA ' ' CZ3' ' A' ' 92' ' ' TRP . 5.9 tpp180 -61.89 -30.34 70.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.001 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -77.42 -51.61 10.5 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -174.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 140' ' ' ILE . 1.8 mm? -56.14 -29.79 61.24 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.675 -2.057 . . . . 0.0 111.625 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -78.71 -46.34 19.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.085 -177.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.35 -22.48 66.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.545 0.688 . . . . 0.0 110.68 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -82.86 -61.06 1.97 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.129 -0.941 . . . . 0.0 112.329 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.578 ' HB3' HD11 ' A' ' 144' ' ' LEU . 92.9 m-85 -112.24 -5.64 14.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -162.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.581 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.04 -36.94 75.87 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.207 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 m -70.22 -5.74 29.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.593 ' HB2' HD13 ' A' ' 144' ' ' LEU . 45.3 mt-30 -110.64 12.91 22.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.007 0.432 . . . . 0.0 111.292 -178.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.474 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 100.98 52.35 1.1 Allowed Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.786 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.756 ' HD1' HG23 ' A' ' 37' ' ' VAL . 43.3 t80 -131.12 134.34 46.47 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.653 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 10.6 tp10 -137.74 144.61 41.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.516 -177.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.426 HD12 ' CE3' ' A' ' 92' ' ' TRP . 60.3 mt -109.29 125.65 66.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.184 0.516 . . . . 0.0 110.426 177.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.521 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 85.6 t80 -111.0 102.02 10.53 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.54 -0.755 . . . . 0.0 108.974 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -95.31 134.45 38.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.252 -174.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.554 HD12 ' CE2' ' A' ' 42' ' ' PHE . 43.2 mt -120.11 112.16 35.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 0.0 110.059 174.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.418 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 30.1 t -91.11 140.66 29.61 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.7 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.645 HD11 HD12 ' A' ' 114' ' ' LEU . 16.6 mt -93.48 13.62 21.21 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.429 ' CG ' ' H ' ' A' ' 78' ' ' GLY . 5.2 p-10 44.13 -111.33 0.21 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.366 -1.288 . . . . 0.0 113.393 178.572 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.429 ' H ' ' CG ' ' A' ' 77' ' ' ASP . . . 92.75 -29.13 8.21 Favored Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 -170.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.73 119.51 11.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -72.58 -30.27 64.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.55 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -67.48 -57.07 7.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.391 -174.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -66.02 -38.31 88.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.397 -174.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.509 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 36.1 t90 -62.42 -48.11 81.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.645 ' HE2' HD11 ' A' ' 23' ' ' LEU . 3.2 ttmt -58.11 -54.89 41.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.488 -174.653 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -66.03 -33.74 76.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.916 -0.583 . . . . 0.0 112.194 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.532 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.2 t -83.38 -32.8 25.99 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.458 -177.167 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.422 ' HB3' HD22 ' A' ' 23' ' ' LEU . . . -75.82 -35.0 60.15 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.503 ' HB2' ' CD2' ' A' ' 23' ' ' LEU . 19.0 t70 -70.34 -28.46 65.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.035 -176.154 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -94.08 16.43 14.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.482 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' ' 94' ' ' CYS . 16.5 mt -88.71 148.32 41.42 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.36 0.6 . . . . 0.0 112.166 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.702 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.6 Cg_endo -76.04 -37.71 1.45 Allowed 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.693 2.929 . . . . 0.0 113.03 177.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.702 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 10.9 p90 -104.58 -167.91 1.41 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.778 -175.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.433 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 38.4 t -82.4 125.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.608 -175.209 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.572 ' HB2' HD12 ' A' ' 90' ' ' LEU . 30.8 t -121.91 108.78 13.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.241 0.543 . . . . 0.0 109.977 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.838 HG11 ' HB2' ' A' ' 20' ' ' LEU . 14.1 t -114.58 162.01 12.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.288 -172.08 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.438 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . 44.0 ttp180 -128.44 137.24 51.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 111.277 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -87.94 145.97 25.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.57 -24.64 45.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.089 0.471 . . . . 0.0 111.357 -176.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.54 32.18 5.7 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.917 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.489 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . -57.76 82.62 0.01 OUTLIER Glycine 0 C--N 1.342 0.876 0 O-C-N 123.757 0.66 . . . . 0.0 114.129 -173.103 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 167.24 -33.9 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.544 1.138 . . . . 0.0 108.561 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.92 12.07 5.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.97 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.52 ' HB3' HG13 ' A' ' 106' ' ' ILE . 41.9 t -62.99 135.85 57.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.604 -177.65 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.56 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.3 m -54.99 -37.24 66.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.13 -176.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -56.84 -56.48 21.07 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.301 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.52 HG13 ' HB3' ' A' ' 103' ' ' SER . 11.5 mt -58.61 -33.74 49.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.664 -175.459 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 18.6 m -71.01 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.427 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 104' ' ' SER . 94.6 mt -64.55 -34.96 79.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.751 0.31 . . . . 0.0 110.977 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -77.69 -4.11 44.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.895 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 t30 . . . . . 0 C--O 1.233 0.221 0 CA-C-O 121.883 0.849 . . . . 0.0 109.728 -174.423 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.645 HD12 HD11 ' A' ' 76' ' ' LEU . 36.2 mt . . . . . 0 C--O 1.232 0.175 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.613 ' HA ' ' O ' ' A' ' 42' ' ' PHE . 43.6 Cg_endo -68.25 150.16 85.55 Favored 'Cis proline' 0 C--N 1.347 0.462 0 C-N-CA 123.84 -1.317 . . . . 0.0 114.234 1.066 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.1 m -136.44 164.35 28.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.207 174.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 p -133.7 152.45 34.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.048 0.452 . . . . 0.0 110.68 -176.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.469 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 71.5 m-85 -133.77 152.1 51.78 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.356 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.633 HD13 HD11 ' A' ' 136' ' ' LEU . 35.4 tp -111.85 142.98 43.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.123 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.68 ' CG2' ' HB ' ' A' ' 38' ' ' VAL . 4.6 m -136.56 146.3 28.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 169.111 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.407 HD21 ' HB2' ' A' ' 125' ' ' GLU . 10.0 p30 -83.38 171.91 13.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -177.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 8.9 ptp180 -65.16 -11.81 44.38 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -168.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -80.55 6.48 12.38 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 172.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.729 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 2.2 t-20 56.21 53.88 8.43 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.988 -173.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.45 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 75.1 mm-40 -129.98 143.95 51.07 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.625 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.646 ' HA ' HG12 ' A' ' 120' ' ' VAL . 2.6 tt -57.07 119.33 6.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.284 0.564 . . . . 0.0 110.954 -172.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.86 -51.84 5.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.161 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.51 171.56 7.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -176.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.571 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -99.09 163.83 12.41 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.638 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.411 ' HA2' HD12 ' A' ' 133' ' ' ILE . . . -44.42 -42.52 7.2 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 -175.134 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -41.42 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 117.27 0.535 . . . . 0.0 110.948 -177.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -63.48 -27.97 69.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.167 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ILE . . . . . 0.833 HG21 HD22 ' A' ' 136' ' ' LEU . 90.0 mt -68.24 -33.28 59.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.604 178.302 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.602 ' NZ ' ' HB2' ' A' ' 134' ' ' LYS . 5.1 mtmp? 72.09 -55.3 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.444 0.698 . . . . 0.0 110.263 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -154.47 124.68 6.84 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.508 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.833 HD22 HG21 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -66.98 -42.98 84.16 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.678 -173.516 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.55 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.0 t70 -52.14 -51.28 58.92 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.107 0.479 . . . . 0.0 109.961 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.28 -50.54 50.09 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.4 175.298 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.494 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -71.6 -46.81 58.14 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -173.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ILE . . . . . 0.873 HD12 HD12 ' A' ' 60' ' ' LEU . 36.4 mt -59.04 -36.52 62.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 0.0 110.379 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -59.35 -49.47 77.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.451 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -75.51 -21.53 57.92 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.711 -178.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' LEU . . . . . 0.559 ' HB3' HG11 ' A' ' 37' ' ' VAL . 86.2 mt -69.59 -40.36 76.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.333 0.587 . . . . 0.0 110.436 175.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.593 HD13 ' HB2' ' A' ' 67' ' ' GLN . 73.2 mt . . . . . 0 C--N 1.324 -0.5 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.253 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.3 tpp . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 120.584 0.23 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.2 t -171.59 156.18 4.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.4 tp -98.57 99.36 10.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.971 0.415 . . . . 0.0 110.306 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.424 ' O ' ' HD3' ' A' ' 6' ' ' PRO . 9.4 tp10 -117.53 154.41 31.53 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.763 HG23 ' HB2' ' A' ' 13' ' ' ALA . 60.8 mt -107.31 96.9 16.96 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 120.771 0.319 . . . . 0.0 110.987 -177.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HD3' ' O ' ' A' ' 4' ' ' GLU . 35.7 Cg_endo -91.87 160.03 3.37 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.721 2.28 . . . . 0.0 111.791 176.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.908 ' HB3' ' HB3' ' A' ' 12' ' ' GLU . 12.0 pt-20 -159.03 163.77 36.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.578 -178.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.57 ' OD2' ' HG2' ' A' ' 9' ' ' LYS . 26.6 t70 173.31 -40.16 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 124.401 1.063 . . . . 0.0 109.854 175.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.57 ' HG2' ' OD2' ' A' ' 8' ' ' ASP . 42.9 mmtm -150.3 165.78 31.97 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.036 -1.438 . . . . 0.0 109.466 -175.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.0 mt 63.0 -90.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 O-C-N 123.8 0.687 . . . . 0.0 111.42 176.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.596 ' HG2' ' OE2' ' A' ' 12' ' ' GLU . 3.4 ttpp -153.28 148.0 26.31 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.688 177.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.908 ' HB3' ' HB3' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -77.92 151.23 33.86 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.601 177.177 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.763 ' HB2' HG23 ' A' ' 5' ' ' ILE . . . 53.59 41.73 32.03 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.252 0.549 . . . . 0.0 110.774 -178.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.08 -15.24 60.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.151 -175.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.9 tp -121.01 131.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.166 0.508 . . . . 0.0 111.122 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.52 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.9 mp -95.95 122.81 47.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.555 175.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.406 ' OD1' ' HB2' ' A' ' 29' ' ' SER . 26.2 t70 -87.08 106.17 17.68 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.69 ' O ' ' HA ' ' A' ' 29' ' ' SER . 13.0 mt -89.4 110.2 21.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.457 -173.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.523 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 34.3 mt-30 -105.59 100.03 9.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.196 0.522 . . . . 0.0 110.776 -178.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 97' ' ' ASP . 32.7 mt -140.22 151.01 44.84 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 174.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.684 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.9 mttm -90.89 155.34 18.82 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.037 -173.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 15.2 p30 -91.76 -172.6 3.26 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.03 -175.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.742 HD11 ' HA ' ' A' ' 84' ' ' LYS . 21.2 tp -57.31 -27.38 62.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.319 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.419 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 68.0 mttm -96.05 -12.5 24.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.062 0.458 . . . . 0.0 111.026 -175.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.91 -3.34 31.86 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.38 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.553 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 11.4 m120 -72.26 118.76 15.55 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.6 m -73.08 106.21 4.85 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.209 -177.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.438 ' HA ' ' HD3' ' A' ' 28' ' ' ARG . 16.5 mmt180 -87.81 142.14 28.05 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.742 -177.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.69 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 31.9 p -135.33 159.76 40.55 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.591 HD22 HG11 ' A' ' 38' ' ' VAL . 47.0 mt -72.72 -21.35 61.05 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.446 0.641 . . . . 0.0 110.004 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.411 ' HA ' ' NZ ' ' A' ' 34' ' ' LYS . 3.6 p -73.17 -15.5 61.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.144 172.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.437 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t70 -87.37 -40.12 14.7 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.751 0.786 . . . . 0.0 109.467 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.683 HD23 HG13 ' A' ' 38' ' ' VAL . 7.8 tp -86.6 15.81 5.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.281 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.6 ' HB2' ' HZ2' ' A' ' 34' ' ' LYS . 4.4 ttmp? -66.76 -11.17 53.76 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.332 0.587 . . . . 0.0 111.517 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.21 -20.58 71.32 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.625 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.669 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 76.7 mttt -129.95 178.8 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.791 HG23 ' HD1' ' A' ' 69' ' ' PHE . 19.6 m -81.02 129.0 38.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 166.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.683 HG13 HD23 ' A' ' 33' ' ' LEU . 24.1 t -101.68 121.62 52.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.123 0.487 . . . . 0.0 111.868 -168.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.407 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 14.5 tp -88.41 116.18 26.46 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.366 173.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.557 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 10.0 mm -90.08 105.25 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.497 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 10.3 t70 -106.99 130.3 54.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.922 0.391 . . . . 0.0 110.902 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.699 ' HB3' HD11 ' A' ' 76' ' ' LEU . 66.5 m-85 -121.3 100.74 7.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.839 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 t -146.64 176.39 9.87 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.625 -178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.507 ' HB ' ' HB3' ' A' ' 77' ' ' ASP . 5.2 m -111.06 119.49 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.135 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.728 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 43.8 m-85 -74.42 83.52 1.96 Allowed 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 173.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 177.45 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.933 0.873 . . . . 0.0 109.791 -168.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.448 ' HB2' HG23 ' A' ' 44' ' ' VAL . 9.0 t-20 -95.04 142.52 27.42 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.06 -1.427 . . . . 0.0 110.837 -167.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -29.53 66.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.437 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.9 ptp -65.98 -22.08 66.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.011 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 t -73.33 -29.73 62.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.54 -52.17 62.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.119 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.26 -37.0 80.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.746 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.471 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 78.6 t60 -64.84 -36.79 85.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.394 178.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.558 ' HA ' HD12 ' A' ' 57' ' ' LEU . 21.5 t-20 -67.17 -32.14 73.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.751 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tt -65.45 -42.74 92.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.972 0.415 . . . . 0.0 109.925 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.87 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.298 0.57 . . . . 0.0 110.368 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.558 HD12 ' HA ' ' A' ' 54' ' ' ASN . 62.7 mt -69.03 -40.46 78.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.757 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 58' ' ' ARG . 9.3 tpt180 -60.48 -30.12 69.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.192 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -76.4 -52.03 10.69 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.849 HD12 HD12 ' A' ' 140' ' ' ILE . 2.2 mm? -57.43 -27.84 62.76 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 112.681 -2.054 . . . . 0.0 111.415 178.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -76.29 -46.57 27.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.007 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.4 -22.18 65.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.247 0.546 . . . . 0.0 110.547 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.543 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 37.3 mttm -77.39 -61.16 2.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.035 -179.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 141' ' ' LYS . 95.8 m-85 -115.17 -8.05 12.4 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -164.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.565 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.89 -36.05 76.14 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.176 0.444 . . . . 0.0 111.491 -176.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.0 m -64.43 -19.99 65.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.646 -178.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -102.98 2.39 34.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.678 0.275 . . . . 0.0 111.267 -176.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 112.54 55.58 0.46 Allowed Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.567 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.791 ' HD1' HG23 ' A' ' 37' ' ' VAL . 31.4 t80 -131.54 143.33 50.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.669 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.75 148.24 38.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.976 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.536 HD13 ' HB3' ' A' ' 57' ' ' LEU . 56.9 mt -107.69 117.86 54.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.144 0.497 . . . . 0.0 110.066 176.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -99.32 99.32 10.25 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 43.9 tt0 -102.45 123.77 46.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.14 -172.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 49.6 mt -105.69 125.24 61.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.612 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.728 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 4.0 p -84.95 121.91 28.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.786 176.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.699 HD11 ' HB3' ' A' ' 42' ' ' PHE . 16.8 mt -106.52 5.74 29.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.284 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.509 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.1 p-10 -68.81 -60.93 2.04 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.162 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.55 32.73 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.478 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 33.8 t70 -113.16 104.18 12.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.375 0.607 . . . . 0.0 110.728 -178.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 31.0 mt-10 -68.78 -14.35 62.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.934 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' HIS . . . . . 0.478 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 61.0 m80 -66.49 -59.35 3.73 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.624 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -74.43 -34.46 63.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.276 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -60.8 -53.38 58.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.955 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.742 ' HA ' HD11 ' A' ' 23' ' ' LEU . 19.3 ttmt -63.87 -41.62 97.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.689 0.281 . . . . 0.0 111.391 -173.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -69.75 -41.46 75.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.84 0.353 . . . . 0.0 111.548 -177.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -75.54 -47.56 26.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.369 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.655 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -67.79 -27.16 66.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.833 -174.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -58.54 -27.26 64.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.25 0.548 . . . . 0.0 111.429 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -108.67 13.0 25.44 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.773 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.7 mt -90.37 144.69 31.27 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 111.718 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.627 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 60.5 Cg_endo -70.25 -52.81 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.688 2.925 . . . . 0.0 113.518 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.627 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.8 p90 -87.41 -169.02 2.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.144 -171.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.8 t -80.96 126.83 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.849 -173.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.655 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 2.0 p -123.73 108.65 12.76 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.508 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 19.7 m -121.43 172.17 8.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.233 -178.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -125.57 144.36 50.6 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.984 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.49 ' HA ' HD13 ' A' ' 20' ' ' LEU . 19.8 t70 -81.6 168.74 17.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.903 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.28 -38.33 27.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.252 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.424 ' CG ' ' HB2' ' A' ' 102' ' ' TYR . 7.3 t-20 -122.97 -11.77 8.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.008 0.432 . . . . 0.0 111.339 -175.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.552 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 78.64 -108.91 2.74 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.472 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.01 -23.94 64.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.079 0.466 . . . . 0.0 110.858 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.424 ' HB2' ' CG ' ' A' ' 99' ' ' ASN . 55.6 m-85 -99.08 29.16 4.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.804 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.488 ' HB3' HG13 ' A' ' 106' ' ' ILE . 37.1 t -60.15 140.0 57.19 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.507 -178.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.562 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.5 m -63.36 -31.26 72.37 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.745 174.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -67.19 -48.82 66.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.995 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.9 HG23 HG13 ' A' ' 111' ' ' VAL . 58.9 mt -53.71 -38.03 33.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.623 175.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 20.4 m -68.61 -39.56 80.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.742 177.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.8 mt -68.59 -38.72 80.9 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.62 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.536 ' OH ' HD11 ' A' ' 18' ' ' ILE . 89.1 m-85 -69.8 -30.56 68.13 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.818 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 63.35 45.82 4.74 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -165.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.9 HG13 HG23 ' A' ' 106' ' ' ILE . 1.5 p -79.85 -46.62 22.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.27 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 30.7 m 71.77 -53.72 0.68 Allowed 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 170.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -67.24 -80.04 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 -170.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.464 HD22 HG22 ' A' ' 111' ' ' VAL . 3.6 mm? 67.41 143.19 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.043 0.537 . . . . 0.0 111.708 -176.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.462 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 52.7 Cg_endo -70.56 162.09 87.1 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.239 -1.567 . . . . 0.0 111.716 -0.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.6 t -147.89 176.66 9.97 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.221 0.534 . . . . 0.0 110.748 -176.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.509 HG12 ' HA3' ' A' ' 130' ' ' GLY . 2.8 p -142.82 154.7 17.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 175.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.557 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.3 m-85 -143.3 158.17 43.86 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.965 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.5 tp -112.33 143.87 42.7 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.64 -173.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.494 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 2.8 t -140.95 131.69 27.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.035 172.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.584 ' HB3' HD22 ' A' ' 143' ' ' LEU . 3.9 p-10 -96.62 176.98 5.81 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.366 176.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.456 ' N ' HG12 ' A' ' 37' ' ' VAL . 84.0 mtt-85 -43.33 -42.56 4.59 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -166.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.561 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 75.3 m-20 -78.95 12.73 2.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 121.995 -0.441 . . . . 0.0 110.457 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 122' ' ' ARG . 61.7 t30 61.18 44.12 10.32 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.487 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.561 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 87.4 mt-10 -96.23 133.13 40.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.288 177.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.7 tt -72.34 107.94 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.965 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 63.8 m -71.66 -55.49 7.62 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.291 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 178.95 173.04 0.77 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.037 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.579 ' HD3' ' OE2' ' A' ' 131' ' ' GLU . 76.4 mtt180 -83.3 159.28 21.93 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.745 176.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.509 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -62.81 -34.33 89.47 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 111.747 -0.541 . . . . 0.0 111.747 175.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.579 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 2.0 mp0 -64.19 -25.39 68.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.248 0.547 . . . . 0.0 110.356 177.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -90.69 -26.86 19.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.315 0.579 . . . . 0.0 110.194 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.588 ' CD1' ' HB2' ' A' ' 119' ' ' LEU . 23.4 mt -99.11 94.79 3.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.147 -175.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.17 11.71 24.67 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.227 173.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -143.43 41.4 1.47 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.283 -170.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.577 ' HA ' ' HB3' ' A' ' 139' ' ' ALA . 3.7 mp -53.66 -35.37 60.95 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -176.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.582 ' HA ' HD11 ' A' ' 60' ' ' LEU . 24.0 t70 -54.53 -58.41 7.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.738 0.304 . . . . 0.0 110.551 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 4.4 mm-40 -65.68 -32.61 74.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 111.916 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.716 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.68 -56.01 24.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.618 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.849 HD12 HD12 ' A' ' 60' ' ' LEU . 48.2 mt -61.47 -34.98 63.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.143 0.497 . . . . 0.0 110.108 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 64' ' ' TYR . 25.6 tttm -60.0 -53.41 58.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.896 176.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 138' ' ' GLU . 13.8 pttm -67.27 -27.34 67.12 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 48.3 mt -64.22 -42.12 96.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.669 0.747 . . . . 0.0 110.027 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.423 HD22 ' NH2' ' A' ' 122' ' ' ARG . 88.0 mt -71.02 -32.73 69.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.987 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.493 ' HB3' ' NE2' ' A' ' 148' ' ' HIS . 29.8 mt-10 -62.25 -6.83 3.44 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -57.49 -17.82 27.54 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 120.388 -0.911 . . . . 0.0 111.985 173.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -64.17 -28.12 69.54 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' HIS . . . . . 0.493 ' NE2' ' HB3' ' A' ' 145' ' ' GLU . 14.7 p80 -89.7 57.94 4.09 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.507 -178.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 37.9 m80 52.43 58.83 4.98 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.77 175.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.548 ' HB3' ' H ' ' A' ' 152' ' ' HIS . 0.0 OUTLIER -175.98 -164.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 -176.343 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.462 ' O ' ' HB3' ' A' ' 152' ' ' HIS . 3.1 t60 -111.19 -3.86 15.23 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 169.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' HIS . . . . . 0.548 ' H ' ' HB3' ' A' ' 150' ' ' HIS . 26.3 p80 . . . . . 0 C--O 1.249 1.076 0 CA-C-N 113.874 -1.512 . . . . 0.0 107.769 173.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.717 0.294 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.1 m -151.96 -67.42 0.17 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.9 tp -153.46 68.06 0.78 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.418 0.628 . . . . 0.0 109.815 177.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -90.58 143.02 27.15 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.925 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.445 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 58.2 mt -99.0 113.14 64.34 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.423 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.536 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 6.9 Cg_exo -76.86 -131.91 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 123.713 2.942 . . . . 0.0 112.696 179.087 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -48.69 136.64 13.18 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.658 -0.701 . . . . 0.0 112.128 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -82.16 75.23 9.1 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 171.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.711 ' HB3' ' NZ ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER 175.61 125.09 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.998 -1.001 . . . . 0.0 108.684 -176.644 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.599 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 43.3 mm -49.99 103.99 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 O-C-N 123.828 0.705 . . . . 0.0 111.984 -176.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.599 ' HB2' ' O ' ' A' ' 10' ' ' ILE . 9.1 ttpp 153.84 4.7 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.124 1.37 . . . . 0.0 108.617 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -74.55 -25.02 59.03 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.531 -172.924 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.74 2.17 10.68 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.801 -176.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.7 m -147.13 76.24 1.41 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.783 0.325 . . . . 0.0 111.67 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.516 HG21 ' O ' ' A' ' 124' ' ' ASN . 9.4 pt 42.5 -159.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 124.74 1.275 . . . . 0.0 113.392 172.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.553 ' O ' HD12 ' A' ' 30' ' ' LEU . 79.5 mt -121.66 103.52 13.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 174.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -104.23 130.81 52.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.527 HG22 ' HG ' ' A' ' 20' ' ' LEU . 14.6 mt -116.76 121.47 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.228 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.558 ' HG3' ' HB3' ' A' ' 29' ' ' SER . 1.7 mp0 -98.08 101.75 13.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.732 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.527 ' HG ' HG22 ' A' ' 18' ' ' ILE . 33.7 mt -132.03 155.6 47.74 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 50.7 mttm -86.94 151.07 23.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.934 0.397 . . . . 0.0 110.793 178.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.643 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -85.39 -177.53 6.49 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.404 175.075 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.876 HD21 ' HB3' ' A' ' 87' ' ' ALA . 1.0 OUTLIER -53.89 -36.73 63.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.546 0.689 . . . . 0.0 112.005 179.346 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HB2' HD22 ' A' ' 26' ' ' ASN . 39.5 mttp -78.22 -18.91 54.8 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.718 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 107.69 9.28 28.97 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.474 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.466 HD22 ' HB2' ' A' ' 24' ' ' LYS . 42.5 m-80 -81.57 108.86 15.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.479 0.18 . . . . 0.0 110.899 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.625 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 62.6 m -68.32 110.22 3.98 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.482 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 5.8 mmm180 -104.38 130.71 52.23 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.991 0.424 . . . . 0.0 110.329 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.558 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 45.7 p -104.31 159.04 16.04 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 169.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 16' ' ' ILE . 50.7 mt -69.6 -26.0 64.24 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.487 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.4 p -68.55 -16.29 63.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.73 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.502 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -78.55 -24.83 45.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 122.295 1.045 . . . . 0.0 108.913 176.788 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.606 HD23 HG13 ' A' ' 38' ' ' VAL . 1.5 tp -99.18 6.08 46.54 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.133 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.515 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 51.0 tttm -69.77 144.53 52.67 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -176.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.73 -21.46 43.79 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 1.104 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 10.0 ttmt -124.07 155.8 37.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.425 -0.887 . . . . 0.0 108.859 178.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.793 HG23 ' HD1' ' A' ' 69' ' ' PHE . 26.9 m -81.59 140.3 16.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -176.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.606 HG13 HD23 ' A' ' 33' ' ' LEU . 32.2 t -122.56 129.02 75.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.27 0.557 . . . . 0.0 111.9 -169.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.603 HD22 HG23 ' A' ' 71' ' ' ILE . 7.0 tt -91.65 112.62 24.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.035 172.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.586 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 15.7 mm -91.03 105.75 16.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.235 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -109.67 139.77 44.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.987 0.423 . . . . 0.0 111.244 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.5 102.43 7.38 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.467 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.9 t -139.63 164.33 30.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.989 0.423 . . . . 0.0 111.62 -174.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.646 HG12 ' HA ' ' A' ' 77' ' ' ASP . 3.3 m -106.47 126.68 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.243 176.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.558 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 21.5 m-85 -87.8 83.42 7.13 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 -177.49 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.527 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 0.3 OUTLIER 177.14 -50.03 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 114.666 -1.152 . . . . 0.0 108.585 -177.296 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.595 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.1 t30 -70.26 133.13 46.71 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.285 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.88 -24.63 38.29 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.557 -173.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.6 mtt -59.76 -26.69 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.851 177.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -75.8 -40.97 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.432 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.47 -59.25 5.26 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.771 -175.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.89 71.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.707 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.496 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 t60 -65.19 -45.37 85.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.793 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.512 ' HA ' HD12 ' A' ' 57' ' ' LEU . 89.5 m-20 -69.07 -25.21 64.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.154 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.6 tt -73.09 -44.9 59.79 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.52 -35.34 74.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.36 0.6 . . . . 0.0 110.03 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -67.07 -37.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.867 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.424 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 10.1 tpp180 -60.95 -28.31 68.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.497 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -77.99 -53.75 7.07 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 122.666 1.222 . . . . 0.0 107.879 -177.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.757 HD12 HD12 ' A' ' 140' ' ' ILE . 2.4 mm? -55.36 -29.1 57.74 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 112.282 -2.235 . . . . 0.0 111.506 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -75.54 -48.29 23.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.912 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -61.71 -21.89 64.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.251 0.548 . . . . 0.0 110.431 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -80.35 -57.57 3.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.319 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -108.17 -5.59 16.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -167.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.514 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -70.63 178.69 2.9 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.867 178.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.5 m 71.61 -35.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.326 0.65 . . . . 0.0 111.602 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.42 ' H ' ' C ' ' A' ' 65' ' ' ALA . 50.6 mt-30 -79.45 -0.49 33.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 111.114 178.006 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.589 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 110.71 47.53 0.78 Allowed Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.907 -0.664 . . . . 0.0 111.896 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.793 ' HD1' HG23 ' A' ' 37' ' ' VAL . 65.4 t80 -129.57 141.2 51.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.55 0.214 . . . . 0.0 110.872 -179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 1.104 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.1 tp10 -137.38 153.32 50.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.14 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.603 HG23 HD22 ' A' ' 39' ' ' LEU . 47.8 mt -111.9 124.77 68.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 173.026 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.1 t80 -109.69 100.92 9.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.204 0.526 . . . . 0.0 109.884 -177.102 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 94' ' ' CYS . 15.9 mm100 -83.33 125.97 32.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.263 -178.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.8 mt -111.71 111.1 34.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 43' ' ' THR . 53.5 p -92.62 115.03 27.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.98 0.419 . . . . 0.0 110.815 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.622 HD11 HD22 ' A' ' 114' ' ' LEU . 0.5 OUTLIER -109.21 29.05 7.88 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.099 0.476 . . . . 0.0 110.106 177.507 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.646 ' HA ' HG12 ' A' ' 44' ' ' VAL . 16.8 t70 -73.41 -77.67 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.572 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.17 -31.13 2.38 Favored Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.872 -178.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -81.61 135.97 35.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.165 0.507 . . . . 0.0 111.763 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -79.34 -52.14 8.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.963 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -66.71 -29.7 69.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -165.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.402 ' CD2' ' HA ' ' A' ' 46' ' ' ASN . 17.6 t80 -88.63 -40.05 13.61 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.48 ' CZ2' ' HG ' ' A' ' 23' ' ' LEU . 28.5 t90 -57.51 -47.62 81.46 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.326 172.433 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.664 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 14.2 mtpp -65.66 -47.71 74.61 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -176.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.5 p -63.92 -38.52 91.38 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.318 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.445 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 16.8 m -78.71 -42.72 27.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.135 -177.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.876 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -88.53 -33.46 17.74 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -169.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 2.0 t0 -73.43 -12.19 60.72 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 110.017 -174.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -101.99 13.49 34.61 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.011 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 87' ' ' ALA . 53.6 mt -96.69 150.33 36.84 Favored Pre-proline 0 N--CA 1.447 -0.592 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.525 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.736 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.2 Cg_endo -74.02 -42.39 0.77 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.991 3.127 . . . . 0.0 113.125 -177.115 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.736 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.7 p90 -90.15 -167.43 1.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.37 -171.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.401 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 49.0 t -81.69 130.79 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.158 -174.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.727 ' HA ' ' HB2' ' A' ' 73' ' ' GLN . 53.1 m -133.52 102.13 5.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.889 0.376 . . . . 0.0 110.233 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.643 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.0 m -114.15 173.25 3.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.761 -175.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -124.34 136.19 53.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.785 0.326 . . . . 0.0 111.611 -177.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -72.35 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.396 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.32 -25.46 33.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.1 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -97.75 -12.33 22.39 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.861 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 61.78 66.07 2.85 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.616 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.53 ' HB2' HD12 ' A' ' 76' ' ' LEU . . . 77.81 -16.11 0.69 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.397 0.679 . . . . 0.0 111.749 177.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -92.05 19.47 6.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.208 0.528 . . . . 0.0 109.712 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.509 ' HB3' HG13 ' A' ' 106' ' ' ILE . 9.2 t -72.81 129.76 38.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.123 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 3.8 p -62.09 -30.88 71.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.458 -177.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.481 ' HA ' HD12 ' A' ' 108' ' ' LEU . 55.6 m-85 -61.55 -34.54 75.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.518 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.525 HG22 HG11 ' A' ' 111' ' ' VAL . 65.6 mt -58.92 -39.28 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.0 0.429 . . . . 0.0 110.478 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.3 m -74.36 -29.06 61.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 177.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.481 HD12 ' HA ' ' A' ' 105' ' ' TYR . 94.9 mt -70.57 -25.35 63.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.209 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.457 ' HB3' ' CE2' ' A' ' 118' ' ' PHE . 68.4 m-85 -77.54 -12.81 60.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.23 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 60.08 55.48 3.71 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -171.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.525 HG11 HG22 ' A' ' 106' ' ' ILE . 14.2 p -71.89 134.38 30.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.578 -178.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 6.1 m -98.59 -31.81 11.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.057 0.456 . . . . 0.0 110.983 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 116' ' ' SER . 36.1 t-20 -152.7 142.07 21.61 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 -178.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.696 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 2.4 tt -144.43 145.26 28.28 Favored Pre-proline 0 CA--C 1.538 0.499 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -178.046 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.696 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 44.3 Cg_exo -51.22 144.04 8.78 Favored 'Cis proline' 0 C--N 1.362 1.261 0 CA-C-N 120.022 1.043 . . . . 0.0 114.079 2.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 113' ' ' ASN . 4.9 t -139.05 175.33 9.65 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.799 -173.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.653 HG11 HD11 ' A' ' 136' ' ' LEU . 9.3 p -142.32 152.54 18.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.822 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.63 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 84.1 m-85 -137.81 161.31 36.91 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 1.007 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.5 tp -110.9 136.76 49.45 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.802 -174.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 2.9 t -137.85 122.95 24.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 172.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.593 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 10.3 p30 -87.57 176.07 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 119.963 -0.695 . . . . 0.0 109.728 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.56 ' NH2' ' HA ' ' A' ' 147' ' ' HIS . 22.9 ptt-85 -64.12 -9.79 18.69 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -165.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.54 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 66.4 t30 -88.36 7.32 33.09 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.452 -0.78 . . . . 0.0 109.518 174.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.516 ' O ' HG21 ' A' ' 15' ' ' ILE . 0.1 OUTLIER 74.83 24.45 1.6 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.914 -178.176 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.593 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 84.7 mt-10 -91.45 116.05 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.576 -172.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 126' ' ' LEU . 1.6 tm? -59.56 107.66 0.62 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.584 0.707 . . . . 0.0 109.228 174.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' SER . . . . . 1.007 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.4 m -80.99 -56.62 3.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.41 -173.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.25 18.82 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.63 ' HG3' ' CE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -104.26 167.49 9.72 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.963 178.789 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.09 51.17 Favored Glycine 0 CA--C 1.52 0.395 0 N-CA-C 114.546 0.579 . . . . 0.0 114.546 -174.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -21.7 46.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.286 0.543 . . . . 0.0 110.328 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.432 ' HB2' ' H ' ' A' ' 129' ' ' ARG . 0.9 OUTLIER -71.5 -36.17 71.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.693 173.772 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 119' ' ' LEU . 96.3 mt -69.53 129.86 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.831 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.99 95.61 5.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 11.3 t0 69.22 117.53 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 O-C-N 124.175 0.922 . . . . 0.0 111.185 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.653 HD11 HG11 ' A' ' 117' ' ' VAL . 14.9 mt -75.83 -25.76 56.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.443 -177.278 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.647 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.5 t70 -60.73 -41.1 94.65 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -70.8 -36.38 72.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.672 172.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.492 ' HB3' ' HA ' ' A' ' 136' ' ' LEU . . . -65.37 -53.35 44.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.921 0.391 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.757 HD12 HD12 ' A' ' 60' ' ' LEU . 55.6 mt -60.34 -40.91 85.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.145 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.703 ' O ' ' HG2' ' A' ' 145' ' ' GLU . 64.6 tttp -58.35 -48.75 79.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -66.32 -20.04 65.98 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.961 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.714 HD21 ' HG ' ' A' ' 119' ' ' LEU . 66.7 mt -66.83 -39.85 87.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.413 0.625 . . . . 0.0 109.866 172.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.516 ' HA ' HH12 ' A' ' 122' ' ' ARG . 96.2 mt -76.5 -47.32 23.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.737 177.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.703 ' HG2' ' O ' ' A' ' 141' ' ' LYS . 3.5 mm-40 -70.19 -20.7 63.1 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.984 -176.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -72.7 55.81 1.69 Allowed Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' HIS . . . . . 0.56 ' HA ' ' NH2' ' A' ' 122' ' ' ARG . 1.1 p-80 -74.46 72.71 1.88 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.187 -0.506 . . . . 0.0 111.926 -176.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 29.1 p80 -90.64 5.66 47.1 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.35 145.21 0.17 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.345 -1.298 . . . . 0.0 108.145 173.207 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 67.47 111.7 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 O-C-N 123.644 0.59 . . . . 0.0 109.851 -173.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 48.2 t60 -61.23 135.64 57.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.384 0.611 . . . . 0.0 111.895 -175.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 . . . . . 0 C--O 1.245 0.855 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 164.411 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.669 0.271 . . . . 0.0 110.651 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -65.99 131.73 46.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.453 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.5 tp -145.21 129.88 18.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.165 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -93.84 139.6 30.68 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.8 mt -129.73 97.93 23.24 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.874 0.369 . . . . 0.0 110.427 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -87.9 -166.12 0.26 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.556 2.838 . . . . 0.0 113.132 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -61.56 -54.81 38.12 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.963 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -81.79 176.01 9.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.959 -177.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.45 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 32.2 mmtm -125.62 -154.72 0.64 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.385 -177.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.5 mm 63.78 -77.43 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.52 -0.208 0 CA-C-O 121.281 0.563 . . . . 0.0 110.947 -171.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.627 ' HD2' ' O ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -158.45 -14.29 0.07 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.736 175.363 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.4 ' H ' ' H ' ' A' ' 11' ' ' LYS . 25.5 mm-40 -81.75 178.93 8.04 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.526 -167.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.05 26.2 16.16 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.273 -167.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.93 -11.35 5.44 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.124 -176.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.676 HD11 HD13 ' A' ' 30' ' ' LEU . 15.3 tt -161.85 144.58 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.194 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.566 ' O ' HD12 ' A' ' 30' ' ' LEU . 4.0 mp -87.65 112.66 23.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.3 108.56 4.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.175 0.512 . . . . 0.0 109.868 -177.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.404 HG12 ' CE1' ' A' ' 105' ' ' TYR . 8.5 mt -101.43 114.93 42.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.043 -178.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.574 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 79.2 mt-30 -105.58 101.11 10.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.869 -178.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.5 mt -132.22 158.28 42.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.193 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 26' ' ' ASN . 54.1 mttm -88.73 145.59 25.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.884 0.373 . . . . 0.0 111.536 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.559 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 25.9 m-20 -69.06 -177.0 0.96 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.263 174.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.536 HD23 ' SG ' ' A' ' 94' ' ' CYS . 3.5 pp -61.7 -28.48 69.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.972 0.891 . . . . 0.0 109.14 168.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.586 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 9.2 mtpm? -79.0 -7.18 57.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.024 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' ' 21' ' ' LYS . . . 81.93 16.04 73.53 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.947 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.559 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 11.6 m-20 -80.91 108.45 14.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.46 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.2 m -68.48 107.56 2.95 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.613 175.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.507 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -100.76 131.21 46.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.145 -178.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.574 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 24.5 p -102.36 161.66 13.53 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 170.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.676 HD13 HD11 ' A' ' 15' ' ' ILE . 51.1 mt -80.29 -29.02 38.17 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.556 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 p -67.5 -8.34 32.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.392 175.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -90.29 -45.14 9.24 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.471 ' CD1' ' HG2' ' A' ' 70' ' ' GLU . 1.4 mm? -67.5 -11.87 58.98 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 113.89 -1.505 . . . . 0.0 111.364 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 124' ' ' ASN . 8.7 ttpp -57.26 101.74 0.07 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.024 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 162.81 -39.95 0.35 Allowed Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.806 -1.317 . . . . 0.0 109.806 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.678 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 98.9 mttt -100.95 174.01 6.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 171.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.565 HG13 ' HD1' ' A' ' 69' ' ' PHE . 3.4 p -83.43 118.64 31.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 167.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.22 124.58 55.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.289 -167.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.465 HD11 ' CD2' ' A' ' 136' ' ' LEU . 12.2 tp -93.04 107.58 19.34 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.205 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.606 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.8 mm -84.73 106.54 14.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.585 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 28.8 t0 -101.62 129.8 47.82 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.883 -177.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -120.97 97.93 5.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.022 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.414 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -148.95 164.8 33.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.013 0.435 . . . . 0.0 111.573 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 76' ' ' LEU . 5.1 m -97.3 144.77 10.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.872 178.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.688 ' H ' ' HB3' ' A' ' 77' ' ' ASP . 7.3 m-85 -105.98 78.44 1.32 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.602 0.715 . . . . 0.0 110.436 172.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -163.15 16.82 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -144.48 131.88 20.85 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.171 -158.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.02 72.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.061 -175.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.14 -24.76 68.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 0.0 110.973 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.3 m -74.76 -27.3 60.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.094 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.52 -38.3 68.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.153 0.501 . . . . 0.0 110.231 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.07 -25.89 61.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.527 0.679 . . . . 0.0 109.802 174.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.53 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.7 t60 -75.32 -47.55 27.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.197 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.658 ' HA ' HD12 ' A' ' 57' ' ' LEU . 33.7 p30 -73.76 -21.28 60.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.86 0.362 . . . . 0.0 110.889 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.31 -57.49 12.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.804 172.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.07 75.13 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.664 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -63.21 -41.25 99.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.935 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -63.25 -31.43 72.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.329 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -74.48 -55.11 6.32 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 122.789 1.281 . . . . 0.0 108.041 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.75 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.0 -30.89 60.46 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.565 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -76.93 -46.25 24.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -62.61 -22.13 66.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.802 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -77.98 -61.61 1.94 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.194 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.564 ' OH ' ' HE3' ' A' ' 141' ' ' LYS . 96.3 m-85 -108.57 -1.43 19.65 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -164.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -68.01 170.22 8.7 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.438 176.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.2 m 71.5 -38.43 0.42 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.119 0.567 . . . . 0.0 111.08 -174.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' A' ' 65' ' ' ALA . 61.1 mt-30 -71.01 -9.81 58.66 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.457 0.646 . . . . 0.0 110.514 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.425 ' O ' HG12 ' A' ' 37' ' ' VAL . . . 117.7 34.36 1.18 Allowed Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.201 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.565 ' HD1' HG13 ' A' ' 37' ' ' VAL . 82.0 t80 -112.36 142.11 45.28 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 177.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.678 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.2 tp10 -143.17 155.34 44.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 178.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.504 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 54.7 mt -123.11 126.16 73.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.176 0.513 . . . . 0.0 109.993 175.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.553 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 78.6 t80 -112.08 100.87 9.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 31.2 tt0 -98.28 129.21 44.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.679 -175.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.408 HD11 ' HE2' ' A' ' 72' ' ' TYR . 57.2 mt -109.31 120.1 59.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.847 175.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 89.7 p -89.48 125.81 35.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.48 0.657 . . . . 0.0 110.336 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.423 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 14.3 mt -102.46 32.81 3.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 175.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.688 ' HB3' ' H ' ' A' ' 45' ' ' TYR . 4.6 p-10 -73.03 177.98 4.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.393 -168.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.89 26.03 4.57 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.011 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -162.89 109.36 1.19 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.466 ' HB2' HH12 ' A' ' 96' ' ' ARG . 35.1 tt0 -58.84 -40.97 85.8 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.706 -176.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -48.6 80.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.628 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -63.28 -47.85 80.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.859 0.362 . . . . 0.0 110.251 -175.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.414 ' HB2' ' HB2' ' A' ' 45' ' ' TYR . 21.5 t90 -61.1 -52.28 65.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.462 175.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.499 ' HD2' ' HB2' ' A' ' 23' ' ' LEU . 26.3 tptp -52.57 -60.26 3.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.188 -177.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.8 m -60.06 -31.53 70.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.98 -173.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.0 t -85.32 -30.71 23.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 0.0 111.533 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.564 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.9 -18.76 26.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.328 0.585 . . . . 0.0 110.617 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.405 ' OD2' ' HG3' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -65.23 -8.14 16.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.414 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -116.37 16.34 15.72 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.497 0.665 . . . . 0.0 110.206 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.564 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 37.1 mt -87.04 141.28 33.02 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 121.495 0.664 . . . . 0.0 111.575 -178.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.712 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 68.7 Cg_endo -80.22 -30.13 2.23 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 123.919 3.079 . . . . 0.0 112.956 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.712 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.2 p90 -102.16 -169.28 1.65 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.258 -172.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.553 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 44.9 t -77.79 133.17 31.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.882 -176.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.536 ' SG ' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -140.63 95.48 2.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.431 0.634 . . . . 0.0 110.399 -176.12 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.487 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 18.0 m -113.79 170.27 4.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.158 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.466 HH12 ' HB2' ' A' ' 80' ' ' GLU . 38.0 ttp180 -126.19 138.31 53.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.599 0.238 . . . . 0.0 111.039 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -81.1 157.59 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.027 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.56 -23.3 37.27 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -175.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -122.59 -11.71 8.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.646 0.26 . . . . 0.0 111.642 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 71.23 -121.1 8.85 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.606 -0.806 . . . . 0.0 111.853 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.26 -14.93 62.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.984 0.421 . . . . 0.0 110.928 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -95.88 12.25 30.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.566 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.488 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.2 t -65.97 141.59 58.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.78 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.8 m -69.82 -24.03 63.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.202 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.404 ' CE1' HG12 ' A' ' 18' ' ' ILE . 63.7 m-85 -59.56 -47.66 84.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.533 HG22 HG11 ' A' ' 111' ' ' VAL . 32.5 mt -57.99 -36.67 57.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.281 -176.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.8 m -68.93 -27.22 65.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.283 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.5 -27.15 64.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.753 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -87.17 1.53 52.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.64 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 48.13 29.03 1.68 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.74 0.816 . . . . 0.0 111.182 -177.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.533 HG11 HG22 ' A' ' 106' ' ' ILE . 11.2 p -43.42 135.47 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.982 -171.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 20.0 p -88.96 -28.98 19.88 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.62 177.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -162.38 146.99 12.23 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.756 0.313 . . . . 0.0 111.434 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 27.7 mt -131.84 160.65 66.71 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 174.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 63.1 Cg_endo -71.7 156.09 97.46 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.853 -1.311 . . . . 0.0 113.017 0.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.48 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 5.9 m -146.16 173.74 11.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.263 -177.187 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.406 HG11 HD21 ' A' ' 136' ' ' LEU . 2.4 p -129.59 161.33 39.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.034 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.606 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.5 m-85 -137.6 157.78 45.78 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 174.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.891 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 6.8 tp -110.96 139.35 46.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -175.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.0 t -135.62 121.02 29.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.552 0.215 . . . . 0.0 110.964 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -76.39 164.15 26.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 34.1 mtt180 -52.3 -18.59 1.64 Allowed 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.155 0.91 . . . . 0.0 113.319 -169.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -84.74 6.25 25.08 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.505 ' HB2' ' HB2' ' A' ' 34' ' ' LYS . 30.4 t30 63.0 52.23 2.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.538 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 49.5 mt-10 -127.22 143.57 51.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.422 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.0 tt -68.85 109.81 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.306 0.574 . . . . 0.0 110.176 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.891 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 58.1 m -76.82 -53.96 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.291 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -162.54 153.83 17.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 -177.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.587 ' O ' HG13 ' A' ' 133' ' ' ILE . 91.7 mtt180 -89.28 156.81 18.5 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.328 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.16 -26.14 60.9 Favored Glycine 0 C--O 1.225 -0.463 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -71.64 -11.78 61.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.443 0.639 . . . . 0.0 110.393 177.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -115.67 -37.22 4.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.069 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.77 HG21 ' HG ' ' A' ' 136' ' ' LEU . 42.7 mt -68.65 145.97 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -128.94 -43.02 1.36 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -130.78 111.92 12.58 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.552 173.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.77 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.8 mp -77.67 -30.48 52.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.963 -178.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -48.38 -57.83 5.49 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.609 0.568 . . . . 0.0 110.529 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.625 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 37.5 mm-40 -58.84 -43.02 90.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.935 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.506 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -60.76 -43.14 98.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.341 -175.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.75 HD12 HD12 ' A' ' 60' ' ' LEU . 40.7 mt -57.89 -44.43 86.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.717 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 138' ' ' GLU . 22.7 mttt -51.1 -55.42 17.78 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.447 0.642 . . . . 0.0 111.234 176.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.625 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 2.6 ptpt -74.2 -18.07 60.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.228 -0.897 . . . . 0.0 112.353 -173.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -83.71 -40.06 19.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.64 0.257 . . . . 0.0 111.245 173.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 71.8 mt -56.82 -49.84 74.19 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.8 175.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -72.28 -55.28 7.42 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.612 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.33 127.43 1.53 Allowed Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.676 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 70.5 t60 -75.88 67.53 2.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.294 0.569 . . . . 0.0 109.685 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -112.98 -54.41 2.63 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.359 -178.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -176.1 171.91 2.46 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 123.483 0.489 . . . . 0.0 110.031 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -68.16 99.86 0.95 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.117 0.484 . . . . 0.0 110.92 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -112.87 -0.61 14.84 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 . . . . . 0 C--O 1.25 1.096 0 CA-C-N 114.108 -1.405 . . . . 0.0 107.99 -174.617 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.405 ' N ' ' HA ' ' A' ' 32' ' ' ASP . 25.2 ttt . . . . . 0 N--CA 1.483 1.216 0 CA-C-O 120.557 0.218 . . . . 0.0 110.49 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.424 ' O ' ' HB ' ' A' ' 31' ' ' THR . 16.6 m -129.95 110.35 11.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.671 -0.241 . . . . 0.0 110.663 -177.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' A' ' 3' ' ' LEU . 2.1 tm? -85.5 105.25 15.97 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 177.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -85.85 142.81 28.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.867 -174.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.6 mt -128.38 95.73 32.46 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.31 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.561 ' HG2' ' HA ' ' A' ' 13' ' ' ALA . 6.1 Cg_exo -75.77 -164.84 0.26 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 123.236 2.624 . . . . 0.0 112.478 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.491 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 44.4 mt-10 -99.06 -169.9 1.84 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.382 0.61 . . . . 0.0 111.795 -175.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -90.76 10.18 27.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.239 174.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.491 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -91.82 -170.48 2.58 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.672 -176.742 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.0 mm -54.43 134.22 17.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.567 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.823 ' HB3' ' HA ' ' A' ' 14' ' ' SER . 90.5 mttt 63.06 71.91 0.5 Allowed 'General case' 0 N--CA 1.438 -1.063 0 O-C-N 123.79 0.681 . . . . 0.0 110.474 -171.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.516 ' H ' ' CD ' ' A' ' 12' ' ' GLU . 1.2 mp0 -65.2 -13.13 57.51 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.202 -176.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.561 ' HA ' ' HG2' ' A' ' 6' ' ' PRO . . . -129.07 -2.16 5.15 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.435 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.823 ' HA ' ' HB3' ' A' ' 11' ' ' LYS . 42.0 m 68.14 -53.15 0.53 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.704 0.801 . . . . 0.0 112.057 -177.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.644 HG21 ' O ' ' A' ' 124' ' ' ASN . 7.7 pt -132.32 -164.76 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 178.084 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.465 ' O ' HD12 ' A' ' 30' ' ' LEU . 89.0 mt -108.55 113.86 45.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 173.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -98.5 108.55 21.27 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 mt -94.4 121.43 45.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.714 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.573 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 32.3 mt-30 -119.04 100.77 7.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.49 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.1 mt -135.3 154.46 51.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 93.0 mttt -79.16 141.62 37.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.159 0.504 . . . . 0.0 110.894 -176.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.63 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 4.0 p-10 -88.45 -169.02 2.39 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.902 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.443 HD13 ' HB3' ' A' ' 87' ' ' ALA . 49.3 tp -52.99 -37.83 61.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.702 177.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.7 mttp -71.2 -27.79 63.75 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -177.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.26 18.52 14.61 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.504 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.403 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 21.7 m120 -108.27 127.9 54.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 178.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.609 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.7 m -63.12 110.6 1.89 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.383 0.611 . . . . 0.0 110.856 178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.573 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 21.3 mmm180 -86.15 134.85 33.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.967 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.1 p -118.5 155.91 30.0 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 173.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.594 HD22 HG11 ' A' ' 38' ' ' VAL . 71.9 mt -73.29 -23.14 60.26 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.424 ' HB ' ' O ' ' A' ' 2' ' ' SER . 5.9 p -71.82 -0.92 12.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.72 175.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.405 ' HA ' ' N ' ' A' ' 1' ' ' MET . 35.5 t70 -98.11 -47.11 5.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.954 0.407 . . . . 0.0 110.882 178.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' A' ' 38' ' ' VAL . 0.6 OUTLIER -91.9 24.72 3.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.71 0.767 . . . . 0.0 109.41 175.334 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.605 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 59.4 tttp -55.92 -42.95 76.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.983 -1.462 . . . . 0.0 112.524 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.16 3.45 38.49 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 115.786 -0.643 . . . . 0.0 113.478 -176.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 6.6 mppt? -125.47 168.81 13.1 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.761 HG21 HD23 ' A' ' 144' ' ' LEU . 45.5 t -73.19 124.91 31.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' A' ' 33' ' ' LEU . 46.7 t -109.01 124.39 65.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.387 0.613 . . . . 0.0 111.462 -169.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.457 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.2 tp -97.35 133.61 41.72 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 171.379 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.592 HG13 ' HB2' ' A' ' 118' ' ' PHE . 1.1 pt -118.1 106.9 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.185 0.517 . . . . 0.0 110.873 175.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.474 ' HB2' ' HA ' ' A' ' 73' ' ' GLN . 13.8 m-20 -98.22 133.28 42.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.858 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -117.33 97.32 5.84 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.459 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 11.1 t -143.7 179.27 7.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 -175.023 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.668 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -126.02 124.29 65.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 120.725 0.298 . . . . 0.0 110.325 -178.879 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.71 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 28.8 m-85 -74.98 79.43 2.18 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.235 0.54 . . . . 0.0 110.006 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 41.3 t30 172.95 -32.33 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.366 -1.288 . . . . 0.0 108.661 174.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.668 ' HB2' HG13 ' A' ' 44' ' ' VAL . 37.4 t-20 -65.1 133.89 52.6 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.852 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -30.8 69.28 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.529 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 90.0 mtp -67.94 -22.54 65.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.347 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -71.14 -23.33 62.05 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.288 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.81 18.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.848 0.356 . . . . 0.0 110.718 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.04 -39.31 93.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.69 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.482 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.3 t60 -62.85 -45.12 94.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.991 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.659 ' HA ' HD12 ' A' ' 57' ' ' LEU . 0.9 OUTLIER -74.7 -22.17 58.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.782 -176.923 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.471 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -68.58 -43.57 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.36 -38.88 81.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.737 174.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 54' ' ' ASN . 86.7 mt -62.51 -42.29 99.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.001 177.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.471 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.4 tpm_? -54.84 -36.03 64.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.777 176.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -79.97 -50.29 10.63 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -173.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.854 HD12 HD12 ' A' ' 140' ' ' ILE . 2.7 mm? -55.77 -30.72 61.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 113.271 -1.786 . . . . 0.0 111.429 178.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -72.72 -48.38 39.24 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.231 0.539 . . . . 0.0 109.685 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -63.38 -21.18 66.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.643 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.564 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 33.5 mttm -82.21 -61.32 1.93 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.925 -178.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.498 ' HB3' HD11 ' A' ' 144' ' ' LEU . 83.8 m-85 -113.35 -5.85 13.55 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -164.015 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.592 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.15 -34.9 75.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.248 0.476 . . . . 0.0 111.585 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 m -63.17 -22.07 66.62 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.775 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -98.57 18.59 16.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.701 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.04 54.43 1.62 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.344 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.592 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 54.0 t80 -132.29 125.9 32.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.71 0.29 . . . . 0.0 110.274 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.461 ' HB3' HD12 ' A' ' 33' ' ' LEU . 28.9 tt0 -125.36 154.73 41.4 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.583 ' HB ' ' CB ' ' A' ' 92' ' ' TRP . 49.8 mt -118.8 126.32 75.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.06 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.497 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 75.7 t80 -112.78 100.12 8.43 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.275 -0.875 . . . . 0.0 108.859 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.474 ' HA ' ' HB2' ' A' ' 41' ' ' ASP . 42.2 tt0 -102.48 126.32 49.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.348 -175.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 54.9 mt -103.56 129.09 56.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.339 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.71 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 3.8 p -95.85 131.63 41.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.487 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 22.2 mt -116.45 33.67 5.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.24 0.543 . . . . 0.0 109.741 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.5 ' OD2' ' HB2' ' A' ' 75' ' ' SER . 3.5 p30 -85.29 -165.91 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.752 -175.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -135.5 30.16 2.81 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.779 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -151.36 101.93 2.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.993 0.425 . . . . 0.0 110.632 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -64.98 -31.76 73.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.653 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -46.0 90.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.564 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -71.97 -42.02 67.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.834 0.349 . . . . 0.0 110.6 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 36.9 t90 -60.77 -48.38 82.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.747 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.465 ' HB2' ' HE3' ' A' ' 84' ' ' LYS . 37.2 ttmt -62.18 -42.14 98.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.806 -175.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 7.9 p -71.22 -40.15 71.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.831 0.348 . . . . 0.0 111.264 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.53 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 25.3 t -69.9 -45.62 67.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.713 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.443 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -66.95 -26.32 66.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.622 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.404 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 27.7 t70 -61.85 -31.34 71.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.763 0.315 . . . . 0.0 111.071 -178.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -102.64 7.86 39.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.935 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 86' ' ' SER . 40.0 mt -94.74 140.62 22.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.233 0.54 . . . . 0.0 111.339 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.62 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.2 Cg_endo -72.45 -49.3 0.28 Allowed 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 123.875 3.05 . . . . 0.0 113.938 -174.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.62 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.1 p90 -81.88 -172.31 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.984 0.421 . . . . 0.0 111.933 -173.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.439 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 90.6 t -85.8 117.52 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.357 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 34.1 m -113.68 108.8 17.61 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.911 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.63 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 23.2 m -114.77 172.1 4.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.934 -179.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -133.04 140.37 47.68 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.085 -177.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -93.03 151.0 20.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.06 -18.52 42.84 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -115.82 -12.17 11.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.812 0.339 . . . . 0.0 111.033 -175.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.487 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 66.41 -121.29 17.43 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.074 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.62 -6.81 43.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.765 0.316 . . . . 0.0 111.303 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -100.97 15.8 27.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.428 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.442 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.6 t -63.6 132.68 51.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.172 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.5 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 16.5 m -59.38 -28.95 67.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.172 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -60.79 -45.42 94.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.735 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.442 HG13 ' HB3' ' A' ' 103' ' ' SER . 43.2 mt -58.0 -36.2 55.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.113 0.482 . . . . 0.0 110.433 -177.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -72.67 -39.66 66.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.535 177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.7 mt -64.26 -32.12 73.58 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.573 -178.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -69.99 -27.3 64.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.947 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.1 t-20 57.97 61.91 2.22 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 -164.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.0 p -69.97 153.37 8.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 114.358 -1.292 . . . . 0.0 110.749 -176.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 47.5 p -93.82 -34.48 13.15 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.931 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 17.5 p-10 -165.43 174.32 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.907 -178.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 115' ' ' PRO . 0.3 OUTLIER -159.59 151.02 16.45 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -177.475 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.613 ' HA ' HD23 ' A' ' 114' ' ' LEU . 33.6 Cg_endo -63.83 139.97 36.87 Favored 'Cis proline' 0 C--N 1.354 0.858 0 C-N-CA 124.371 -1.096 . . . . 0.0 113.433 1.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.11 177.6 7.33 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.98 -177.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 7.9 p -138.05 159.25 33.09 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.647 ' HE2' ' HD2' ' A' ' 129' ' ' ARG . 86.2 m-85 -138.04 163.27 32.02 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 1.025 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.4 tp -110.98 135.03 52.1 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.745 -174.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 49.1 t -131.18 117.53 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.32 0.581 . . . . 0.0 110.301 172.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.463 ' HA ' HD13 ' A' ' 143' ' ' LEU . 31.4 t30 -70.84 161.15 31.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 122' ' ' ARG . 17.0 ptt180 -73.88 29.68 0.08 Allowed 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -170.036 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.541 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 4.4 t-20 -120.37 2.97 10.83 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 169.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.644 ' O ' HG21 ' A' ' 15' ' ' ILE . 0.2 OUTLIER 69.28 62.78 0.29 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.709 -167.016 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.541 ' HG3' ' HB3' ' A' ' 123' ' ' ASN . 38.3 mt-10 -122.2 123.81 42.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.019 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 tt -62.04 106.8 0.76 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 171.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' SER . . . . . 1.025 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 47.0 m -83.08 -54.7 4.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.972 -172.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -167.66 172.13 9.58 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.755 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.647 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 19.6 mmt85 -78.62 175.39 10.43 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -80.63 -26.62 53.65 Favored Glycine 0 C--N 1.315 -0.585 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.616 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.459 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 mp0 -75.47 -41.85 54.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.164 0.507 . . . . 0.0 112.021 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.623 HD22 ' H ' ' A' ' 129' ' ' ARG . 12.5 p30 -81.03 -6.58 58.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.704 -176.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.645 HG21 ' HG ' ' A' ' 136' ' ' LEU . 63.3 mt -85.61 110.26 19.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.313 0.578 . . . . 0.0 109.975 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -61.01 -25.36 66.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.026 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 137' ' ' ASP . 36.2 t70 -173.05 116.48 0.28 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.645 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.4 mp -75.17 -28.52 60.11 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.924 -0.311 . . . . 0.0 111.043 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.471 ' HB3' ' OD2' ' A' ' 135' ' ' ASP . 9.3 t70 -53.51 -54.93 30.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 173.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.22 -48.55 68.07 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.666 172.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.509 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -64.24 -52.12 60.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.373 -172.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.854 HD12 HD12 ' A' ' 60' ' ' LEU . 37.6 mt -61.3 -36.83 75.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.275 0.56 . . . . 0.0 110.295 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 17.2 ttpt -60.11 -40.0 88.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.149 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 139' ' ' ALA . 17.1 ptpt -85.02 -19.73 31.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.244 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.515 HD11 ' HG ' ' A' ' 119' ' ' LEU . 16.0 mt -75.15 -32.83 61.43 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.682 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.761 HD23 HG21 ' A' ' 37' ' ' VAL . 34.0 mt -53.91 -35.47 61.68 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.518 178.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.692 ' HB2' ' HA ' ' A' ' 151' ' ' HIS . 9.2 pt-20 -84.11 -39.23 19.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.962 0.41 . . . . 0.0 110.149 176.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 114.81 -122.27 5.6 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.871 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -90.64 29.52 1.3 Allowed 'General case' 0 C--N 1.326 -0.413 0 O-C-N 122.791 -0.24 . . . . 0.0 110.838 -177.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' HIS . . . . . 0.672 ' HA ' ' OE1' ' A' ' 145' ' ' GLU . 0.5 OUTLIER 55.66 54.16 8.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.489 179.366 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -141.34 8.6 2.02 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.318 174.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 33.4 t60 -174.7 95.84 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.046 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.692 ' HA ' ' HB2' ' A' ' 145' ' ' GLU . 32.3 p80 -70.09 162.7 27.74 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 175.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 45.5 t60 . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.453 -0.784 . . . . 0.0 109.024 171.48 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 120.689 0.28 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 m -80.4 146.88 31.25 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.227 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.569 HD12 ' N ' ' A' ' 4' ' ' GLU . 1.5 pp -80.0 -22.24 42.71 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.391 0.615 . . . . 0.0 110.623 177.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.569 ' N ' HD12 ' A' ' 3' ' ' LEU . 0.7 OUTLIER -157.55 -175.05 5.17 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 106.082 -1.821 . . . . 0.0 106.082 175.369 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.503 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 45.6 mm 62.81 88.08 0.12 Allowed Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -171.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -58.18 164.28 8.76 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.296 2.664 . . . . 0.0 114.526 -166.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.684 ' HA ' ' HG3' ' A' ' 12' ' ' GLU . 7.5 pt-20 -151.09 104.62 3.15 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.732 -1.576 . . . . 0.0 108.439 -177.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -157.1 97.99 1.7 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.823 0.344 . . . . 0.0 111.804 -170.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm 68.63 -75.5 0.07 Allowed 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.145 175.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.8 pt -148.94 30.05 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 CA-C-N 114.557 -1.202 . . . . 0.0 110.563 -176.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -134.26 41.18 2.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.841 0.829 . . . . 0.0 110.34 -176.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.684 ' HG3' ' HA ' ' A' ' 7' ' ' GLU . 4.8 mp0 -74.88 134.99 41.54 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.182 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.474 ' C ' ' H ' ' A' ' 15' ' ' ILE . . . 68.23 -71.35 0.11 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.457 -173.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.1 t 70.23 -15.93 0.32 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.364 0.666 . . . . 0.0 111.662 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.474 ' H ' ' C ' ' A' ' 13' ' ' ALA . 5.3 tp -163.98 145.23 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.454 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.1 mp -98.9 104.56 16.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.11 110.9 2.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.288 0.566 . . . . 0.0 110.093 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.465 HG21 ' CD1' ' A' ' 74' ' ' ILE . 25.1 mm -90.4 108.6 19.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.259 -178.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.626 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 19.4 mt-30 -105.31 99.8 9.4 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.192 0.52 . . . . 0.0 110.795 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.2 mt -138.35 159.0 43.19 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.647 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 46.0 mtmt -89.69 138.18 31.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.737 0.779 . . . . 0.0 111.395 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.636 ' OD1' ' HG ' ' A' ' 23' ' ' LEU . 9.9 t70 -71.09 169.04 15.85 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.819 -1.537 . . . . 0.0 109.821 176.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.848 HD13 ' HA ' ' A' ' 88' ' ' ASP . 2.5 pp -51.82 -34.68 41.34 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.695 0.759 . . . . 0.0 111.212 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -69.34 -6.91 32.76 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.115 177.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.53 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 89.74 7.91 68.18 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.308 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -101.69 118.29 36.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.553 0.216 . . . . 0.0 111.487 -175.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.647 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 24.3 m -58.28 124.01 18.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.223 0.535 . . . . 0.0 110.839 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.626 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.3 mmm180 -107.03 142.98 35.8 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.563 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.5 p -120.17 162.34 19.51 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.461 ' HG ' ' H ' ' A' ' 18' ' ' ILE . 49.9 mt -80.1 -29.65 39.07 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.3 p -59.33 -22.89 61.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.701 173.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -85.5 -52.56 5.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.153 176.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -13.98 11.52 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.221 -178.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.613 ' NZ ' ' HB3' ' A' ' 34' ' ' LYS . 3.6 ttpm? -53.48 -14.98 0.91 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.224 1.01 . . . . 0.0 112.475 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.53 ' C ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.1 -16.37 59.8 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.651 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.53 ' HD2' ' C ' ' A' ' 35' ' ' GLY . 2.9 mptp? -136.14 -178.9 5.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 110.397 176.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.719 HG21 HD23 ' A' ' 144' ' ' LEU . 56.3 t -78.58 123.29 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 172.063 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.1 t -103.32 122.27 55.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.308 0.575 . . . . 0.0 112.204 -163.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.785 HD11 HD21 ' A' ' 136' ' ' LEU . 13.0 tp -92.06 122.13 34.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.739 171.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.534 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.0 mm -98.98 106.03 18.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.714 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 25.6 t70 -108.4 131.07 55.14 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.869 -178.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.511 ' HD2' HD11 ' A' ' 76' ' ' LEU . 32.7 m-85 -119.63 97.77 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.106 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.583 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.2 t -137.39 164.87 27.58 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.996 0.427 . . . . 0.0 111.233 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.597 HG23 ' HB2' ' A' ' 47' ' ' ASN . 3.4 m -102.49 116.75 46.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.051 0.453 . . . . 0.0 110.437 177.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' A' ' 83' ' ' TRP . 7.4 m-85 -74.89 84.13 2.2 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.699 0.761 . . . . 0.0 109.057 175.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 177.69 -37.81 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.149 -165.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.597 ' HB2' HG23 ' A' ' 44' ' ' VAL . 10.1 t-20 -89.76 146.56 24.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.383 -169.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.31 -30.77 71.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.724 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.3 mmm -64.27 -27.19 68.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.793 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.9 m -69.33 -28.25 66.07 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.164 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.72 -55.7 15.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.866 0.365 . . . . 0.0 110.67 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.03 77.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.623 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.495 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 67.8 t60 -66.13 -38.25 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.454 178.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.447 ' HA ' HD12 ' A' ' 57' ' ' LEU . 4.3 t30 -66.95 -39.45 87.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.455 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -57.34 -50.23 73.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.501 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.03 83.8 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.005 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.4 mt -62.97 -42.38 99.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 109.943 175.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -61.68 -28.83 69.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.023 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -72.28 -53.25 13.02 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.708 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -56.56 -32.1 64.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 112.345 -2.207 . . . . 0.0 111.072 176.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -73.1 -47.66 42.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.119 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -61.93 -22.46 65.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.263 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -79.7 -55.83 4.72 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.666 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.611 ' HB3' HD11 ' A' ' 144' ' ' LEU . 93.6 m-85 -118.09 -11.4 10.18 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -165.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.528 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -56.33 -42.87 78.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -174.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.3 p -54.2 -43.48 70.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.414 -176.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -69.69 -33.21 72.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 151.81 47.74 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.303 -0.951 . . . . 0.0 112.582 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.644 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 66.9 t80 -127.92 138.77 52.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.359 -0.238 . . . . 0.0 110.359 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.36 155.56 49.25 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.454 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 46.3 mt -116.84 114.97 47.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.446 0.641 . . . . 0.0 110.503 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 87.7 t80 -100.48 101.3 12.21 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.606 178.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.714 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 10.7 mt-30 -94.86 143.18 26.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.031 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.465 ' CD1' HG21 ' A' ' 18' ' ' ILE . 57.3 mt -127.21 124.88 65.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.715 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.627 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 10.7 p -92.49 129.91 38.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.947 0.403 . . . . 0.0 111.116 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.511 HD11 ' HD2' ' A' ' 42' ' ' PHE . 25.1 mt -112.45 10.5 19.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.88 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.627 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 3.9 p-10 -69.22 -49.99 51.32 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.322 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.94 -34.54 3.24 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.632 176.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -87.04 136.36 32.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.934 0.874 . . . . 0.0 111.367 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 44.1 tt0 -78.7 -29.0 45.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.7 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -79.59 -50.6 10.45 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.286 -167.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -65.44 -39.31 91.9 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.498 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 16.0 t90 -61.99 -47.93 82.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.792 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.698 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 46.2 tttm -68.34 -49.72 58.33 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.968 -176.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.6 p -58.93 -30.31 67.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.202 0.525 . . . . 0.0 111.423 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.1 m -82.84 -46.22 13.32 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.684 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.512 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.24 -18.8 27.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -171.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.848 ' HA ' HD13 ' A' ' 23' ' ' LEU . 3.6 t70 -55.36 -33.56 63.52 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.93 0.492 . . . . 0.0 111.981 -170.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -104.26 11.72 34.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.145 -176.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.512 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 23.3 mt -81.83 157.7 68.86 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 121.121 0.486 . . . . 0.0 111.712 -176.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.624 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 72.1 Cg_endo -69.8 -44.41 2.07 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.744 2.963 . . . . 0.0 114.208 -176.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.624 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -100.75 -170.69 1.89 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 112.005 -171.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.559 HG11 ' HG3' ' A' ' 28' ' ' ARG . 90.3 t -83.79 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.775 -176.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 84.0 m -136.17 108.81 7.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.07 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.428 HG12 ' CA ' ' A' ' 22' ' ' ASP . 14.6 m -113.89 159.8 13.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.009 -177.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 80' ' ' GLU . 12.2 ttp180 -117.73 134.42 54.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.379 -177.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -92.69 143.56 26.18 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.35 -14.09 55.84 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -99.95 -13.31 19.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.744 -172.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.41 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . 64.62 -98.45 0.28 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.747 178.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -105.92 1.49 26.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.956 0.408 . . . . 0.0 110.891 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -104.56 9.47 35.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.119 0.485 . . . . 0.0 110.193 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.534 ' HB2' HG13 ' A' ' 106' ' ' ILE . 4.2 m -65.27 122.21 16.59 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.554 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.543 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.3 m -55.17 -27.1 43.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.867 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -55.59 -47.24 76.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.613 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.537 ' CG2' HG11 ' A' ' 111' ' ' VAL . 53.1 mt -57.07 -34.77 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.765 -176.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.9 m -77.17 -37.27 54.11 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 177.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 104' ' ' SER . 96.7 mt -63.58 -37.65 88.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.599 -178.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -71.53 -24.41 61.94 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.412 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 59.53 79.88 0.21 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 122.1 0.953 . . . . 0.0 108.758 -165.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.537 HG11 ' CG2' ' A' ' 106' ' ' ILE . 9.9 p -92.71 145.5 7.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.077 -174.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 15.1 m -90.81 -40.6 11.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.294 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -170.11 127.52 0.85 Allowed 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -174.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.469 HD13 ' OG ' ' A' ' 116' ' ' SER . 3.7 mm? -88.83 147.32 38.79 Favored Pre-proline 0 N--CA 1.465 0.28 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.97 143.02 74.8 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 123.86 -1.308 . . . . 0.0 112.919 0.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.469 ' OG ' HD13 ' A' ' 114' ' ' LEU . 13.3 m -121.04 169.99 9.96 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.464 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.8 p -142.25 156.71 19.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.534 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.7 m-85 -140.23 160.16 40.57 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.921 HD13 HD11 ' A' ' 136' ' ' LEU . 13.9 tp -111.0 134.93 52.21 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -174.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.49 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.6 t -135.51 120.44 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.775 0.321 . . . . 0.0 110.554 177.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.641 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.1 p30 -77.74 167.56 21.36 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 4.68 0.78 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -168.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -95.65 5.3 51.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 35.1 t30 64.42 48.05 2.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.277 -172.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.641 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 42.4 mt-10 -119.12 136.85 53.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.615 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.86 118.05 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.324 0.583 . . . . 0.0 110.801 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.619 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 18.4 m -87.31 -53.45 4.83 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.877 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.09 169.14 14.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.172 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.47 ' O ' HG13 ' A' ' 133' ' ' ILE . 93.4 mtt180 -91.7 168.33 11.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.885 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -65.16 -36.55 93.03 Favored Glycine 0 CA--C 1.509 -0.316 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.463 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 pm0 -75.93 -0.14 20.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.086 0.469 . . . . 0.0 111.125 177.001 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -110.07 -19.47 13.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.167 0.508 . . . . 0.0 110.05 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.535 HD11 ' HB2' ' A' ' 119' ' ' LEU . 97.2 mt -82.9 108.3 15.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.73 -177.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.78 ' HD2' ' H ' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -82.99 -26.34 31.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.955 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -161.36 110.43 1.58 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.921 HD11 HD13 ' A' ' 119' ' ' LEU . 2.8 tp -76.78 -33.17 58.05 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.754 -175.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.456 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.1 t70 -51.54 -52.83 43.81 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.48 177.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.543 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 28.7 mm-40 -56.57 -52.22 65.64 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.64 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.468 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.97 -50.6 71.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.183 -172.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.708 HD12 HD12 ' A' ' 60' ' ' LEU . 52.2 mt -59.55 -40.54 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.213 0.53 . . . . 0.0 110.249 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.428 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 29.4 ttpt -56.78 -47.59 79.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.016 178.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.543 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 11.5 ptpt -81.54 -18.88 43.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.76 -176.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 40.2 mt -71.91 -39.59 69.42 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 110.401 173.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.719 HD23 HG21 ' A' ' 37' ' ' VAL . 66.6 mt -58.37 -39.74 80.39 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.504 0.669 . . . . 0.0 109.938 176.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.607 ' HA ' ' CE1' ' A' ' 152' ' ' HIS . 39.5 mt-10 -66.87 -64.32 0.88 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.055 175.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 98.77 -48.05 1.36 Allowed Glycine 0 N--CA 1.442 -0.93 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.772 -177.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 60.87 -89.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.435 0.694 . . . . 0.0 111.411 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 62.18 -78.45 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.95 0.5 . . . . 0.0 111.665 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -153.63 24.7 0.52 Allowed 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.497 ' CE1' ' O ' ' A' ' 152' ' ' HIS . 0.2 OUTLIER -142.2 169.14 18.14 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.729 178.631 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.526 ' O ' ' HB2' ' A' ' 152' ' ' HIS . 48.2 t60 -75.42 74.38 2.49 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.835 0.35 . . . . 0.0 110.725 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' HIS . . . . . 0.607 ' CE1' ' HA ' ' A' ' 145' ' ' GLU . 66.0 t-80 . . . . . 0 C--O 1.249 1.033 0 C-N-CA 124.202 1.001 . . . . 0.0 108.359 174.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 mmt . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.9 m -65.38 -45.48 83.87 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -97.38 93.34 6.43 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 168.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -78.34 137.24 37.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.816 -174.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 68.6 mt -107.52 112.68 62.31 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.403 -178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -85.38 -179.76 3.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.681 2.254 . . . . 0.0 112.004 177.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 48.96 -171.75 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.478 1.111 . . . . 0.0 113.409 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -159.38 14.57 0.15 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.113 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.722 ' HG2' ' H ' ' A' ' 10' ' ' ILE . 3.2 ttmp? -137.84 -146.26 0.21 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.779 -167.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.722 ' H ' ' HG2' ' A' ' 9' ' ' LYS . 37.4 pt -77.96 170.83 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 167.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.888 ' HE2' HD11 ' A' ' 16' ' ' ILE . 6.0 tmtm? -51.43 109.6 0.36 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.171 0.51 . . . . 0.0 111.612 -177.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -130.28 -28.07 2.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.633 0.73 . . . . 0.0 110.081 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -126.27 -31.84 2.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.724 -1.126 . . . . 0.0 111.252 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 63.3 m -47.41 119.09 2.49 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.813 0.816 . . . . 0.0 111.699 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.4 tp -70.22 138.47 21.93 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 113.811 -1.541 . . . . 0.0 110.718 176.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.888 HD11 ' HE2' ' A' ' 11' ' ' LYS . 4.2 mp -101.69 126.23 55.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -80.03 108.02 13.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.491 HD11 ' OH ' ' A' ' 109' ' ' TYR . 11.1 mt -96.07 125.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.729 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.612 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 28.9 mt-30 -118.73 99.96 7.11 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.985 0.421 . . . . 0.0 110.365 -178.213 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.7 mt -133.63 156.46 47.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 95.4 mttt -87.64 139.63 30.34 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.053 0.454 . . . . 0.0 111.308 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.584 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 7.8 p30 -87.82 -167.22 1.81 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.892 -176.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.578 HD13 ' HB3' ' A' ' 87' ' ' ALA . 55.3 tp -50.02 -36.15 27.63 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.272 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.618 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 8.9 mtmp? -84.87 -5.53 59.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.497 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.88 17.48 63.27 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -176.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -97.08 117.26 30.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.209 -0.496 . . . . 0.0 110.275 -177.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.589 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 54.7 m -61.74 118.94 7.8 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.153 0.501 . . . . 0.0 111.269 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.612 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.9 mmm180 -101.38 139.17 37.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.498 176.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 36.8 p -118.06 161.89 19.09 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 172.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 16' ' ' ILE . 58.0 mt -79.88 -21.29 44.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.642 0.734 . . . . 0.0 109.863 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.35 -8.21 52.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.625 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -89.94 -60.51 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.994 0.426 . . . . 0.0 110.512 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.41 ' CD2' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -77.96 9.18 3.81 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 121.782 0.801 . . . . 0.0 111.066 -177.265 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.497 ' NZ ' ' HB3' ' A' ' 124' ' ' ASN . 24.1 ttmm -54.75 141.45 32.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.477 171.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.64 -25.53 8.5 Favored Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 -173.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.499 ' NZ ' ' HB2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -120.96 170.62 9.33 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.287 173.346 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.675 HG13 ' HG2' ' A' ' 122' ' ' ARG . 1.6 m -79.95 134.71 26.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.481 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 41.3 t -117.02 130.98 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-O 121.184 0.516 . . . . 0.0 111.155 -170.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.54 ' HB3' HG23 ' A' ' 71' ' ' ILE . 11.8 tp -94.96 107.52 19.56 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.649 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.687 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.8 mm -85.6 105.49 14.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.133 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.438 ' CG ' ' HE2' ' A' ' 53' ' ' HIS . 1.8 t70 -107.18 131.6 53.97 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.287 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -116.03 97.32 6.01 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.734 ' O ' ' HA ' ' A' ' 75' ' ' SER . 22.7 m -144.63 147.32 32.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.182 0.515 . . . . 0.0 111.161 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.556 HG13 ' HB2' ' A' ' 47' ' ' ASN . 1.6 p -95.46 123.01 47.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 122.236 -0.29 . . . . 0.0 110.946 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.691 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 30.5 m-85 -82.69 79.07 9.2 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.01 0.91 . . . . 0.0 109.659 175.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.424 ' HB3' HG22 ' A' ' 44' ' ' VAL . 7.3 t-20 -178.13 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 113.569 -1.65 . . . . 0.0 109.078 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.556 ' HB2' HG13 ' A' ' 44' ' ' VAL . 30.0 t-20 -71.85 142.86 49.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.558 -178.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.07 -30.12 69.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.822 -175.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 21.8 ptp -71.45 -17.06 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.0 0.429 . . . . 0.0 111.088 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.2 m -71.17 -30.58 66.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.517 -177.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.61 -47.31 86.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.878 0.371 . . . . 0.0 111.137 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.133 0.492 . . . . 0.0 110.646 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.483 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.5 t60 -68.12 -40.89 82.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.625 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.539 ' HA ' HD12 ' A' ' 57' ' ' LEU . 92.5 m-20 -63.65 -34.01 76.91 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.792 0.33 . . . . 0.0 111.05 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.11 -53.75 54.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.415 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.54 -35.59 76.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.06 -178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.539 HD12 ' HA ' ' A' ' 54' ' ' ASN . 86.8 mt -64.17 -41.55 97.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.515 0.674 . . . . 0.0 109.69 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 58' ' ' ARG . 28.5 tpt85 -64.56 -27.34 68.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.094 -178.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.474 ' OE2' ' HE3' ' A' ' 63' ' ' LYS . 3.7 tm-20 -75.54 -56.16 4.97 Favored 'General case' 0 CA--C 1.489 -1.385 0 CA-C-O 123.003 1.382 . . . . 0.0 107.801 -174.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.546 HD12 HD12 ' A' ' 140' ' ' ILE . 3.0 mm? -55.02 -29.33 57.15 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 111.819 -2.446 . . . . 0.0 111.067 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -66.86 -49.17 66.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.24 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.34 -26.38 66.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.713 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.474 ' HE3' ' OE2' ' A' ' 59' ' ' GLU . 74.2 mttt -77.02 -61.48 1.97 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.685 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -109.54 -11.84 14.75 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -164.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.587 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.53 -37.9 82.69 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.189 0.45 . . . . 0.0 111.494 -177.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.4 m -65.11 -13.87 59.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.839 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -101.39 6.64 42.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.087 0.47 . . . . 0.0 110.955 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.51 54.24 0.89 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.175 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.594 ' HD1' HG23 ' A' ' 37' ' ' VAL . 37.2 t80 -130.57 131.66 45.13 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 178.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -130.69 156.15 45.4 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.601 HD12 ' CE3' ' A' ' 92' ' ' TRP . 43.6 mt -122.34 129.13 75.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-O 120.995 0.426 . . . . 0.0 110.152 -175.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.484 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 89.8 t80 -113.27 100.4 8.54 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.237 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.79 140.99 29.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.819 -177.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.46 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 59.9 mt -127.16 107.8 17.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.606 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.734 ' HA ' ' O ' ' A' ' 43' ' ' THR . 0.0 OUTLIER -77.77 129.44 35.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.998 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.462 ' H ' ' HA ' ' A' ' 44' ' ' VAL . 48.2 mt -110.34 38.75 2.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.553 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.1 p30 -100.72 -178.77 3.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.449 -175.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 -25.64 4.8 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.481 173.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.607 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 30.4 t70 -103.14 97.47 7.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.997 0.427 . . . . 0.0 110.689 -177.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.662 ' HB3' ' CZ ' ' A' ' 96' ' ' ARG . 10.0 pt-20 -74.79 -13.99 60.65 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.622 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' HIS . . . . . 0.607 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.2 OUTLIER -52.07 -50.59 61.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.403 173.367 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -70.81 -39.68 72.94 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.165 0.507 . . . . 0.0 110.553 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.616 ' HE3' ' HB2' ' A' ' 80' ' ' GLU . 31.4 t90 -60.27 -46.58 89.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.077 176.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -64.43 -43.73 93.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.281 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.7 p -69.45 -39.06 77.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.5 t -72.87 -37.41 67.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.599 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.611 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -70.17 -23.09 62.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.091 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.03 -27.08 68.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.708 0.766 . . . . 0.0 110.329 174.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -102.46 12.52 36.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.995 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.499 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 24.8 mt -97.98 147.35 32.95 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 121.408 0.623 . . . . 0.0 112.215 -177.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.765 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 14.8 Cg_endo -100.21 3.33 0.8 Allowed 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 124.495 3.463 . . . . 0.0 114.168 -176.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.765 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 2.4 p90 -136.72 -170.09 2.61 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.219 -0.301 . . . . 0.0 111.047 -174.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.486 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 78.7 t -80.89 127.02 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.945 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.611 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 1.6 p -129.63 103.38 6.82 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.209 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.584 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 6.4 m -114.73 156.24 15.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.662 ' CZ ' ' HB3' ' A' ' 80' ' ' GLU . 12.6 ttp180 -120.91 139.06 53.75 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.347 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -89.24 148.54 23.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.59 -16.4 51.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 0.0 111.697 -176.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -107.34 -12.15 15.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.17 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.43 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 62.31 -120.69 22.86 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.014 -177.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.48 -5.73 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.356 . . . . 0.0 111.476 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -99.6 12.87 35.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.525 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.419 ' HB3' HG13 ' A' ' 106' ' ' ILE . 42.9 t -64.9 133.53 52.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.798 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.2 m -63.31 -25.1 68.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.796 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -60.63 -44.15 96.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.353 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.419 HG13 ' HB3' ' A' ' 103' ' ' SER . 65.3 mt -56.73 -41.3 74.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.989 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.5 m -66.12 -27.81 68.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.965 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -73.9 -18.27 60.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.04 -179.168 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.679 ' HB2' HG23 ' A' ' 111' ' ' VAL . 87.8 m-85 -98.27 0.73 46.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.45 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 75.42 -5.28 2.2 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 123.972 0.795 . . . . 0.0 110.501 -177.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.679 HG23 ' HB2' ' A' ' 109' ' ' TYR . 92.3 t -58.34 129.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.415 -171.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 20.1 p -130.79 16.02 5.28 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.973 176.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -113.38 -100.89 0.42 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.277 -176.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.509 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 46.8 mt 67.93 154.68 0.14 Allowed Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 123.589 0.756 . . . . 0.0 112.436 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.509 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 17.3 Cg_exo -67.61 152.59 85.96 Favored 'Cis proline' 0 C--N 1.354 0.847 0 C-N-CA 123.442 -1.483 . . . . 0.0 111.934 0.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.444 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 68.7 m -151.21 175.84 11.78 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.034 0.445 . . . . 0.0 111.149 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.454 HG11 HD21 ' A' ' 136' ' ' LEU . 4.4 p -132.66 161.11 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.095 179.18 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.687 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.2 m-85 -137.42 162.02 34.76 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.921 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 11.9 tp -109.61 135.84 49.93 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.725 -176.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.541 ' CG1' ' HA ' ' A' ' 124' ' ' ASN . 4.0 t -129.84 125.63 61.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.227 0.537 . . . . 0.0 110.654 174.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.546 ' HA ' HG12 ' A' ' 37' ' ' VAL . 28.7 t30 -80.77 167.97 19.34 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.402 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.675 ' HG2' HG13 ' A' ' 37' ' ' VAL . 16.4 mtp180 -56.48 -25.15 50.23 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -165.216 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.711 ' HB2' ' CD ' ' A' ' 125' ' ' GLU . 90.4 m-20 -90.01 13.16 15.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -177.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.541 ' HA ' ' CG1' ' A' ' 120' ' ' VAL . 2.8 t-20 60.48 57.55 2.77 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.407 -172.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.711 ' CD ' ' HB2' ' A' ' 123' ' ' ASN . 2.2 mp0 -109.33 134.91 51.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.178 175.028 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.42 107.08 2.31 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.921 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -78.78 -50.78 10.75 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.36 -173.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.09 167.31 10.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.5 -178.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.602 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -94.58 154.58 17.3 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.547 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -51.5 -41.33 48.8 Favored Glycine 0 C--N 1.33 0.231 0 O-C-N 123.434 0.458 . . . . 0.0 113.871 -175.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.463 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.6 OUTLIER -71.36 -18.09 62.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.897 0.38 . . . . 0.0 110.655 -178.016 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -101.43 -15.14 17.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.719 -176.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.851 HG21 ' HG ' ' A' ' 136' ' ' LEU . 90.0 mt -77.08 99.84 2.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.163 0.506 . . . . 0.0 110.387 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.5 ptmt -74.31 87.77 2.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.202 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.415 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 33.8 t70 69.54 116.3 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.376 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.851 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.1 mp -76.13 -33.57 59.42 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.123 -177.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.519 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.3 t70 -54.15 -59.72 4.28 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.588 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 0.7 OUTLIER -51.89 -46.43 64.52 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.404 173.268 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.617 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.48 -51.71 68.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.033 0.382 . . . . 0.0 112.033 -174.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 136' ' ' LEU . 47.7 mt -57.64 -43.43 83.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.155 0.502 . . . . 0.0 110.081 177.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.484 ' HG2' ' OE1' ' A' ' 145' ' ' GLU . 26.4 ttpp -59.66 -50.83 72.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.951 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.617 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 24.9 pttt -73.35 -17.13 61.32 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 42.9 mt -70.62 -40.72 72.99 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 169.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 87.8 mt -67.93 -44.98 75.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.076 175.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.484 ' OE1' ' HG2' ' A' ' 141' ' ' LYS . 47.5 mt-10 -73.85 -2.99 26.05 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.723 177.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -71.51 -59.54 4.82 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 44.5 m80 60.33 -167.59 0.18 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.764 0.316 . . . . 0.0 110.479 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 28.3 p80 -119.54 24.7 10.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.712 0.767 . . . . 0.0 109.551 174.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -169.59 100.29 0.33 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.087 177.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -71.96 146.62 47.63 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 122.009 0.909 . . . . 0.0 113.1 -170.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -178.77 -44.81 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 178.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 6.1 t60 . . . . . 0 C--O 1.244 0.779 0 CA-C-N 112.973 -1.921 . . . . 0.0 106.91 165.54 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.3 mmt . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p -87.22 -26.2 23.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 169.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.502 HD13 ' O ' ' A' ' 127' ' ' SER . 48.3 tp -147.8 141.13 25.23 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.211 -1.359 . . . . 0.0 108.769 174.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -153.19 92.94 1.66 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.613 0.72 . . . . 0.0 110.637 176.075 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.45 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 48.2 mm -81.35 126.94 75.28 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.82 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 5' ' ' ILE . 8.4 Cg_exo -71.27 -168.72 0.36 Allowed 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.884 2.389 . . . . 0.0 112.61 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.443 ' CB ' ' HD3' ' A' ' 9' ' ' LYS . 38.9 mt-10 -130.38 156.28 44.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.341 -177.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -79.49 68.0 5.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.815 0.817 . . . . 0.0 109.518 174.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.443 ' HD3' ' CB ' ' A' ' 7' ' ' GLU . 53.1 mtpt -139.25 -143.82 0.17 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.82 -174.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.0 mm -69.37 -2.11 2.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.422 0.63 . . . . 0.0 111.912 -174.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.611 ' HZ1' ' HA ' ' A' ' 14' ' ' SER . 47.3 tttm -159.5 117.22 2.72 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.677 178.261 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -98.39 -172.99 2.44 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 168.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 40.36 87.22 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 172.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.611 ' HA ' ' HZ1' ' A' ' 11' ' ' LYS . 57.9 m -89.26 11.53 18.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.524 0.678 . . . . 0.0 109.939 175.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 tt -78.79 157.78 4.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.796 175.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.424 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.3 mp -89.19 114.49 27.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.01 121.83 18.18 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.477 HD11 ' OH ' ' A' ' 109' ' ' TYR . 9.4 mt -105.07 106.83 21.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.675 -174.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.436 ' CG ' ' HB3' ' A' ' 29' ' ' SER . 19.2 mt-30 -102.05 100.43 10.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.024 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.527 HD22 ' HA ' ' A' ' 97' ' ' ASP . 43.9 mt -138.38 156.7 47.35 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.3 mtmt -99.98 153.84 18.87 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 120.58 -0.448 . . . . 0.0 111.584 -172.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.76 -166.4 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.884 -174.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.543 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 6.3 mp -53.61 -46.77 70.54 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.729 177.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -68.32 -44.76 74.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.974 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.479 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 124.7 19.53 2.49 Favored Glycine 0 N--CA 1.44 -1.084 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.79 -176.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -92.32 119.73 32.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.585 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 45.5 m -64.93 127.83 33.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.99 0.424 . . . . 0.0 111.31 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.2 mmm180 -108.84 136.32 48.59 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.436 ' HB3' ' CG ' ' A' ' 19' ' ' GLN . 57.3 p -119.0 165.46 14.08 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.7 mt -80.99 -28.59 35.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.084 0.469 . . . . 0.0 109.806 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 p -63.87 -20.84 66.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.086 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -81.38 -44.3 17.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 122.016 0.913 . . . . 0.0 108.572 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.471 HD23 HG13 ' A' ' 38' ' ' VAL . 2.7 tp -80.26 15.86 1.45 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.798 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.575 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 47.3 tttp -69.41 -14.29 62.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.905 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.14 10.73 65.01 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.324 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 3.4 mttm -144.97 177.9 8.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.08 0.467 . . . . 0.0 110.389 177.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.636 HG23 ' HD1' ' A' ' 69' ' ' PHE . 14.7 m -92.07 125.84 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.515 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 38.7 t -107.23 135.71 44.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 112.257 -165.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.612 HD11 HG23 ' A' ' 117' ' ' VAL . 2.0 tm? -96.38 120.22 36.3 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.478 -0.783 . . . . 0.0 108.961 170.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.1 mm -93.95 105.09 16.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 175.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.573 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 31.0 t0 -108.69 135.4 49.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 0.0 111.003 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.73 ' HB3' HD21 ' A' ' 114' ' ' LEU . 70.3 m-85 -123.4 115.44 21.62 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.288 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.1 t -155.95 174.13 15.78 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.736 0.303 . . . . 0.0 110.692 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.579 ' HB ' ' OD2' ' A' ' 77' ' ' ASP . 2.0 m -116.44 144.83 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.361 176.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.607 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 15.1 m-85 -102.24 81.03 2.03 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.6 . . . . 0.0 110.72 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.549 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 0.8 OUTLIER 177.9 21.68 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.502 -1.681 . . . . 0.0 107.895 178.617 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -141.34 129.47 22.12 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.592 -163.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.85 78.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.039 -173.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -64.28 -21.24 66.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.011 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -74.64 -27.68 60.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.331 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.57 -51.46 35.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 110.894 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.36 -34.01 77.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.252 0.548 . . . . 0.0 110.44 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.403 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 68.3 t60 -67.45 -35.86 80.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.271 178.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -66.95 -37.3 84.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.608 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.6 tt -64.81 -42.04 95.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.361 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.48 85.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.301 0.572 . . . . 0.0 110.333 177.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -66.37 -41.33 89.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.69 176.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.437 ' HA ' ' HZ3' ' A' ' 92' ' ' TRP . 17.0 tpt180 -58.67 -31.94 68.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.102 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.83 -55.88 6.76 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.813 1.292 . . . . 0.0 107.728 -173.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.8 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -54.51 -31.74 56.67 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 112.124 -2.307 . . . . 0.0 111.388 177.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -76.72 -43.39 37.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.037 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -61.63 -22.05 64.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.323 0.582 . . . . 0.0 110.591 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -85.38 -61.62 1.72 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.546 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.569 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 95.7 m-85 -108.23 -8.79 15.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -165.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.489 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -65.97 -30.41 70.96 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 121.984 -0.447 . . . . 0.0 111.594 -176.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.8 m -68.24 -18.37 64.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.966 0.413 . . . . 0.0 111.038 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.569 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.4 mp0 -91.1 -61.97 1.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.425 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -177.4 38.88 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.876 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.636 ' HD1' HG23 ' A' ' 37' ' ' VAL . 73.5 t80 -113.17 145.67 40.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.607 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 9.3 tp10 -145.06 147.03 32.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 179.017 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.575 HD12 ' CE3' ' A' ' 92' ' ' TRP . 59.1 mt -111.79 131.18 63.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.982 0.42 . . . . 0.0 110.297 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.505 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.5 t80 -114.87 101.37 8.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.203 177.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 18.4 mt-30 -92.96 136.19 33.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.873 -177.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 56.4 mt -117.59 113.2 41.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.144 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 43' ' ' THR . 9.3 m -91.09 119.04 30.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.362 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.3 mt -100.97 15.23 29.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.409 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.607 ' HB2' ' H ' ' A' ' 45' ' ' TYR . 4.7 t70 -71.85 166.98 20.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.494 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.95 -18.5 46.92 Favored Glycine 0 N--CA 1.441 -1.017 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.584 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -111.19 114.71 28.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.305 0.574 . . . . 0.0 110.951 -178.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.573 ' HB3' ' NH1' ' A' ' 96' ' ' ARG . 11.0 pt-20 -80.15 -20.65 44.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.362 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -46.14 81.17 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.565 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -70.2 -34.65 73.19 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.543 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 12.5 t90 -59.86 -59.96 4.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.939 173.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -63.25 -40.42 97.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.275 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 59.8 m -68.31 -34.09 75.51 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.406 -178.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -23.36 29.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.062 0.458 . . . . 0.0 110.365 178.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.563 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -81.38 -18.22 46.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.405 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -53.69 -44.58 69.88 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 111.321 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -91.06 16.45 9.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.851 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.563 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 17.7 mt -86.63 139.09 33.37 Favored Pre-proline 0 N--CA 1.452 -0.374 0 CA-C-O 121.439 0.638 . . . . 0.0 111.895 -179.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.719 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 73.6 Cg_endo -79.13 -30.78 2.51 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.818 3.012 . . . . 0.0 113.485 -176.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.719 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.2 p90 -105.28 -163.26 0.93 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.124 -173.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.64 127.39 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -177.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.8 t -129.67 115.91 18.05 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.6 m -121.95 177.96 3.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.5 -176.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' A' ' 80' ' ' GLU . 32.5 ttp180 -129.93 139.14 51.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.571 0.224 . . . . 0.0 110.593 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.527 ' HA ' HD22 ' A' ' 20' ' ' LEU . 18.4 t70 -83.32 151.07 25.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.942 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.22 -25.29 34.3 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -104.83 -12.78 16.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -173.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.73 -87.49 0.17 Allowed Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.972 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -107.22 -9.98 15.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.006 0.431 . . . . 0.0 110.973 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -103.01 22.62 13.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.114 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.435 ' HB2' HG13 ' A' ' 106' ' ' ILE . 2.2 m -69.25 133.63 48.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.067 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.547 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 14.5 m -57.1 -33.35 67.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.311 176.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -56.35 -48.07 77.54 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.393 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.666 HG23 ' CG1' ' A' ' 111' ' ' VAL . 41.9 mt -55.53 -37.42 45.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.666 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 32.8 t -77.92 -22.18 50.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.857 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.9 mt -80.3 -30.65 38.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.469 -177.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.477 ' OH ' HD11 ' A' ' 18' ' ' ILE . 82.7 m-85 -85.46 -19.92 30.52 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.033 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.434 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.1 OUTLIER 54.95 56.58 6.46 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -162.522 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.666 ' CG1' HG23 ' A' ' 106' ' ' ILE . 8.9 p -58.84 -33.11 48.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.112 -1.404 . . . . 0.0 112.301 -169.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 25.1 m 71.26 -56.02 0.64 Allowed 'General case' 0 CA--C 1.534 0.345 0 O-C-N 123.378 0.424 . . . . 0.0 111.792 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -156.24 164.64 38.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.087 0.47 . . . . 0.0 111.056 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.73 HD21 ' HB3' ' A' ' 42' ' ' PHE . 0.6 OUTLIER -125.49 168.96 12.29 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.64 177.564 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.435 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 3.8 Cg_exo -74.74 158.3 99.0 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 124.039 -1.234 . . . . 0.0 112.015 0.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 42' ' ' PHE . 13.6 m -125.86 155.03 41.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.037 0.446 . . . . 0.0 111.375 -173.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.612 HG23 HD11 ' A' ' 39' ' ' LEU . 5.5 p -144.08 143.48 23.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.31 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.598 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 75.9 m-85 -136.07 162.37 33.08 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.81 HD13 HD11 ' A' ' 136' ' ' LEU . 27.3 tp -111.06 143.66 41.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.515 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 53.5 t -133.84 126.6 51.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.532 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.692 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.5 p30 -83.29 167.97 17.12 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 49.2 ptt85 -63.97 1.57 0.65 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -168.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -98.5 7.06 46.64 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.575 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 48.5 t30 60.99 57.33 2.58 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.845 -170.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.692 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 39.8 mt-10 -129.27 145.27 51.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.355 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.04 110.93 4.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.277 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.502 ' O ' HD13 ' A' ' 3' ' ' LEU . 7.7 m -80.51 -47.6 14.01 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.693 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.21 165.81 10.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.212 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.619 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 12.1 mpt_? -92.2 162.09 14.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 175.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.06 -44.82 92.91 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 121.485 -0.388 . . . . 0.0 112.845 -176.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.639 ' CD ' ' H ' ' A' ' 131' ' ' GLU . 0.2 OUTLIER -68.88 -23.07 64.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.155 0.502 . . . . 0.0 110.481 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -92.68 -1.87 56.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.95 -176.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.63 HG21 HD13 ' A' ' 136' ' ' LEU . 96.5 mt -99.54 99.85 9.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.558 0.694 . . . . 0.0 110.302 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.424 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 13.1 ptmm? -60.51 -36.38 78.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.065 176.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.424 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 23.5 t70 -166.0 116.75 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.353 -176.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.81 HD11 HD13 ' A' ' 119' ' ' LEU . 1.8 tp -75.96 -26.66 57.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.57 -175.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -54.89 -53.43 55.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.719 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -58.53 -51.1 71.31 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.029 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.639 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.66 -54.54 42.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.905 -173.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.8 HD12 HD12 ' A' ' 60' ' ' LEU . 38.5 mt -63.33 -35.23 71.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.796 0.331 . . . . 0.0 111.008 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 145' ' ' GLU . 26.9 ttpp -62.39 -49.8 74.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.006 0.431 . . . . 0.0 110.462 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.93 -23.73 63.26 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.5 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.639 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 78.4 mt -66.85 -40.26 87.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.104 0.478 . . . . 0.0 110.103 173.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 96.7 mt -70.27 -40.47 74.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.823 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 141' ' ' LYS . 45.2 mt-10 -62.07 -34.44 76.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.042 175.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 47.3 35.59 9.79 Favored Glycine 0 CA--C 1.521 0.407 0 N-CA-C 115.443 0.937 . . . . 0.0 115.443 165.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 37.2 m80 71.52 -8.04 1.12 Allowed 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 173.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -69.34 118.63 12.46 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 118.9 0.773 . . . . 0.0 110.03 -176.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 68.58 7.17 5.88 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.057 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 46.2 m80 67.62 2.33 2.94 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.467 0.707 . . . . 0.0 112.74 176.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -170.23 178.23 3.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.42 . . . . 0.0 111.045 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.164 -0.922 . . . . 0.0 109.036 174.234 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.8 ttm . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.904 0.383 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.3 m -110.74 -174.85 2.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.846 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.423 ' HA ' HD22 ' A' ' 3' ' ' LEU . 1.1 tm? -77.01 76.72 3.56 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -117.45 98.66 6.52 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.356 -176.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.438 HG22 ' H ' ' A' ' 7' ' ' GLU . 49.2 mm -105.72 118.59 54.98 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.483 -177.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.76 22.91 0.8 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.037 2.491 . . . . 0.0 113.562 -176.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.438 ' H ' HG22 ' A' ' 5' ' ' ILE . 17.5 mm-40 -99.89 78.37 2.11 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.986 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.416 ' C ' ' HD2' ' A' ' 9' ' ' LYS . 8.6 t70 -82.17 168.77 17.36 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.501 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 12.0 mptt -111.77 -8.27 14.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.618 0.723 . . . . 0.0 110.645 -176.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.1 mt -118.59 14.75 7.07 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 114.656 -1.156 . . . . 0.0 107.936 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.462 ' HE2' ' HB3' ' A' ' 11' ' ' LYS . 31.0 ttpt -174.65 56.69 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.284 -1.326 . . . . 0.0 108.872 -173.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -55.38 136.89 49.0 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.341 -179.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 58.14 68.56 0.82 Allowed 'General case' 0 C--O 1.234 0.257 0 O-C-N 123.836 0.71 . . . . 0.0 110.387 -174.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.8 m -70.06 -33.39 71.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.358 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.6 tp -162.23 139.25 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.434 177.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.474 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -100.81 103.68 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.49 108.52 2.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.335 0.588 . . . . 0.0 110.521 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 29' ' ' SER . 19.4 mm -87.15 124.2 40.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.645 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.575 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 11.0 mt-30 -120.86 100.43 7.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.89 0.376 . . . . 0.0 111.149 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.3 mt -142.03 153.88 44.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.225 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 92.6 mttt -79.81 144.54 33.44 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.244 0.545 . . . . 0.0 110.528 178.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.582 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 3.3 p-10 -90.55 -169.84 2.53 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.04 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.498 ' CD2' ' HA ' ' A' ' 88' ' ' ASP . 37.9 tp -59.0 -36.4 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.42 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -69.71 -24.59 63.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.166 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.63 15.22 21.41 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.218 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.543 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 26.0 m120 -99.51 122.52 42.71 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 17.0 m -66.72 106.87 1.96 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 172.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.575 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -86.82 142.43 28.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.082 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.54 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 73.8 p -121.72 156.95 32.01 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 172.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.447 HD12 ' O ' ' A' ' 16' ' ' ILE . 53.7 mt -74.38 -27.02 60.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.091 0.472 . . . . 0.0 109.868 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.8 p -67.81 -14.79 63.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.187 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -91.28 -40.25 11.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 0.0 109.446 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.563 HD23 HG13 ' A' ' 38' ' ' VAL . 3.4 tp -77.11 3.65 12.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.346 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 36.9 ttpt -61.22 -18.42 58.23 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.436 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -71.73 -12.39 74.22 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.588 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -123.7 -177.89 3.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.98 0.419 . . . . 0.0 110.103 177.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.684 HG23 ' HD1' ' A' ' 69' ' ' PHE . 5.5 m -93.71 126.75 46.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 167.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.566 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 22.1 t -102.16 129.45 53.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.255 0.55 . . . . 0.0 112.132 -165.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.727 HD12 ' HZ ' ' A' ' 69' ' ' PHE . 6.2 tt -92.87 110.06 21.51 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 171.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.639 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 35.0 mm -84.74 106.15 14.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.99 0.424 . . . . 0.0 110.31 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.651 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 5.4 t70 -104.14 134.61 47.11 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.123 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.4 ' HB3' HD11 ' A' ' 114' ' ' LEU . 17.0 m-85 -119.54 108.91 15.09 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.503 ' O ' ' HA ' ' A' ' 75' ' ' SER . 6.4 t -143.85 -175.45 4.59 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.219 0.533 . . . . 0.0 110.75 -174.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.766 HG13 ' HB2' ' A' ' 47' ' ' ASN . 2.5 p -145.12 128.15 10.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.653 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.516 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 30.1 m-85 -78.12 79.4 4.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.853 0.835 . . . . 0.0 109.807 178.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 176.1 -27.56 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 113.543 -1.662 . . . . 0.0 109.687 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.766 ' HB2' HG13 ' A' ' 44' ' ' VAL . 41.7 t-20 -73.21 135.33 44.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.729 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.82 68.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.345 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.21 -24.43 63.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.8 m -63.29 -28.98 70.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -176.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.38 -59.62 4.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.833 0.349 . . . . 0.0 111.256 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.05 -32.72 73.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.922 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.428 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 67.8 t60 -62.46 -42.96 99.84 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.022 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -70.04 -21.59 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.662 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.3 -44.02 65.96 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 177.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.3 75.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.36 0.6 . . . . 0.0 110.091 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.466 ' HB3' HD13 ' A' ' 71' ' ' ILE . 82.9 mt -65.96 -40.61 91.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.837 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.526 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 28.5 tpt180 -60.68 -28.82 68.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.22 177.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.55 -56.97 4.14 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 122.528 1.156 . . . . 0.0 108.148 -171.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.708 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -57.91 -32.48 67.79 Favored 'General case' 0 N--CA 1.425 -1.68 0 CA-C-N 112.348 -2.205 . . . . 0.0 111.515 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -75.65 -44.43 42.6 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.293 0.568 . . . . 0.0 109.647 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 15.1 t30 -59.75 -26.11 65.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.866 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -83.55 -61.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.701 -1.136 . . . . 0.0 112.434 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -105.69 -7.2 18.58 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -163.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.582 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.17 -35.37 69.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.12 0.418 . . . . 0.0 111.93 -177.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 m -66.21 -12.44 56.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.183 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.445 ' HB2' HD13 ' A' ' 144' ' ' LEU . 50.3 mt-30 -106.27 17.58 23.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.173 -178.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.02 46.39 3.11 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.113 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.727 ' HZ ' HD12 ' A' ' 39' ' ' LEU . 46.9 t80 -120.8 136.24 54.95 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -142.59 142.79 32.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.193 0.52 . . . . 0.0 110.277 -176.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.482 HG23 HD22 ' A' ' 39' ' ' LEU . 60.0 mt -102.52 132.66 48.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.3 -176.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.506 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.7 t80 -115.7 101.2 8.62 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.676 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.651 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 2.0 mt-30 -90.72 128.08 36.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.469 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.3 mt -109.01 109.36 28.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.706 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 43' ' ' THR . 1.1 m -93.94 142.1 27.76 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.454 -178.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 mt -115.73 27.79 9.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.835 0.35 . . . . 0.0 110.96 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.4 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.7 p30 -84.1 178.48 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.871 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -137.73 35.43 2.05 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.983 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -138.36 134.14 33.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.984 0.421 . . . . 0.0 110.363 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -77.45 -31.42 53.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 51.0 m80 -68.79 -51.88 36.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.439 -167.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -71.49 -44.55 64.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.516 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 56.7 t90 -59.68 -49.6 77.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.491 -179.221 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 51.9 tttm -61.33 -61.72 2.34 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -177.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.8 m -55.44 -38.77 69.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.037 -173.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.484 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.4 m -74.48 -39.51 62.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.421 -177.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.407 ' HA ' HD12 ' A' ' 90' ' ' LEU . . . -87.44 -20.87 26.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.062 0.458 . . . . 0.0 111.458 -174.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.537 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -60.0 -35.54 75.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.532 -176.905 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -96.26 8.52 43.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.732 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 86' ' ' SER . 25.6 mt -93.82 149.05 36.4 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-O 121.249 0.547 . . . . 0.0 111.55 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.581 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 98.6 Cg_endo -74.32 -56.96 0.07 OUTLIER 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.59 2.86 . . . . 0.0 113.86 -175.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.581 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.5 p90 -83.37 -166.5 1.39 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.946 -169.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -87.52 133.32 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.813 -171.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 83.3 m -133.14 110.66 10.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.904 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.582 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 16.0 m -116.34 163.34 13.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.928 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -129.98 144.04 51.12 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.445 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -76.48 162.03 28.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.103 178.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.54 -34.95 65.45 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -177.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.425 ' HA ' HD22 ' A' ' 99' ' ' ASN . 1.0 OUTLIER -122.43 -11.27 8.34 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.751 -174.965 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.76 -113.72 3.82 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.252 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.31 5.58 4.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.851 0.358 . . . . 0.0 111.892 -174.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -110.29 9.51 23.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.973 0.416 . . . . 0.0 110.206 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 14.4 t -63.83 130.2 43.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.127 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.7 m -58.49 -28.95 65.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.699 -177.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.49 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 80.3 m-85 -61.54 -36.9 81.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.007 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.481 HG23 ' HB ' ' A' ' 111' ' ' VAL . 62.3 mt -59.08 -34.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.603 -175.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 41.2 m -80.09 -18.6 49.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.921 0.391 . . . . 0.0 111.115 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.4 mt -81.0 -33.44 33.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.07 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.566 ' HB2' HG23 ' A' ' 111' ' ' VAL . 78.3 m-85 -83.76 -9.43 58.81 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.81 178.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.9 t30 62.6 78.38 0.29 Allowed 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 -168.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.874 HG11 HD12 ' A' ' 114' ' ' LEU . 21.3 t -119.51 89.9 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 CA-C-O 121.339 0.59 . . . . 0.0 110.306 -178.338 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 13.4 p -91.59 -4.74 54.98 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.288 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -148.17 84.72 1.52 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.2 0.524 . . . . 0.0 111.427 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.874 HD12 HG11 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -83.08 157.84 65.34 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 170.48 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.606 ' HA ' ' CG ' ' A' ' 114' ' ' LEU . 7.5 Cg_exo -71.24 162.83 87.21 Favored 'Cis proline' 0 C--N 1.352 0.722 0 C-N-CA 124.64 -0.983 . . . . 0.0 113.409 1.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 49.2 m -143.82 173.85 11.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.386 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.83 156.41 17.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.449 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.639 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 78.3 m-85 -146.36 158.68 43.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.772 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 17.7 tp -112.57 145.31 40.56 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.924 -177.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.599 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 34.6 t -138.5 126.12 28.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.645 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -80.92 168.26 18.93 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -76.72 16.3 0.53 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -172.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -105.8 10.59 32.58 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 167.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.451 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 40.0 t30 56.48 63.75 1.88 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.908 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.599 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 46.1 mt-10 -127.46 140.87 51.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.673 176.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.5 tt -69.68 107.75 3.58 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.772 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 52.6 m -74.53 -52.98 10.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.335 -177.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -165.56 164.5 19.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.116 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.583 ' O ' HG13 ' A' ' 133' ' ' ILE . 99.4 mtt180 -102.06 151.62 21.93 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.441 ' O ' ' HB2' ' A' ' 131' ' ' GLU . . . -54.83 155.62 8.39 Favored Glycine 0 N--CA 1.452 -0.237 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 173.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 130' ' ' GLY . 26.2 mm-40 71.84 -40.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.119 0.568 . . . . 0.0 110.742 -172.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.441 ' O ' ' HG3' ' A' ' 134' ' ' LYS . 4.1 m-20 -80.39 -29.86 37.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.954 0.407 . . . . 0.0 110.026 177.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 129' ' ' ARG . 51.3 mt -59.52 -44.32 92.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.807 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 132' ' ' ASN . 50.9 mttp 74.29 -58.47 0.58 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.428 0.691 . . . . 0.0 110.851 179.295 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -139.77 110.47 6.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.541 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.888 HD13 HD11 ' A' ' 140' ' ' ILE . 0.3 OUTLIER -77.11 -28.01 54.25 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.11 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.412 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.0 t70 -57.21 -52.27 65.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.693 0.282 . . . . 0.0 111.012 -172.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.46 -34.97 79.13 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.015 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.591 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -63.26 -52.36 62.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.694 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.888 HD11 HD13 ' A' ' 136' ' ' LEU . 30.1 mt -65.15 -40.04 87.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -62.75 -44.22 96.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.845 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -72.02 -19.7 61.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 79.1 mt -68.48 -39.76 81.22 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.637 0.732 . . . . 0.0 109.349 171.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.445 HD13 ' HB2' ' A' ' 67' ' ' GLN . 88.4 mt -74.37 -44.58 51.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.918 177.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -71.47 -2.54 17.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.119 176.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -68.8 -15.06 68.53 Favored Glycine 0 C--N 1.333 0.394 0 N-CA-C 111.756 -0.537 . . . . 0.0 111.756 173.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 35.1 p-80 -135.51 86.91 2.28 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -148.85 -177.59 5.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.224 -166.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 65.4 m-70 -135.84 132.09 36.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 168.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.555 ' O ' ' HB2' ' A' ' 151' ' ' HIS . 3.2 t60 72.06 140.88 0.05 Allowed 'General case' 0 C--O 1.234 0.287 0 O-C-N 124.36 1.038 . . . . 0.0 108.68 -170.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.555 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 45.8 m170 75.94 -58.03 0.55 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -164.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 69.2 t60 . . . . . 0 C--O 1.246 0.915 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.953 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 120.638 0.256 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.3 m -143.05 -79.5 0.22 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.972 0.415 . . . . 0.0 110.242 -177.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.31 48.62 0.18 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.432 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 1.6 pm0 -82.43 10.48 7.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.643 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.8 tt -99.64 100.82 11.7 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.58 174.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -82.69 9.45 4.04 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.657 2.238 . . . . 0.0 113.391 -174.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -86.53 173.83 9.34 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.175 -174.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 52.88 21.13 1.87 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.363 1.065 . . . . 0.0 112.03 -178.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -107.75 -170.61 1.72 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.109 176.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.1 pt -90.43 1.72 7.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.917 0.865 . . . . 0.0 109.897 174.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.528 ' HG3' ' OG ' ' A' ' 14' ' ' SER . 19.9 tptm -131.5 83.0 2.07 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.344 -1.298 . . . . 0.0 108.567 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.47 152.33 24.04 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.478 -175.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.93 31.35 19.97 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 123.803 0.689 . . . . 0.0 112.345 174.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.528 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 8.1 m -55.08 -44.45 74.84 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.531 0.682 . . . . 0.0 109.462 174.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.7 tp -159.66 123.02 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.581 174.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.477 ' O ' HD12 ' A' ' 30' ' ' LEU . 95.0 mt -87.6 101.94 11.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.885 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -68.73 107.87 3.18 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.803 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 29' ' ' SER . 23.4 mm -87.93 113.8 25.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.222 -178.036 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.536 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 80.3 mt-30 -108.78 100.26 9.51 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.377 0.608 . . . . 0.0 110.864 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.641 ' HB2' HG11 ' A' ' 95' ' ' VAL . 45.5 mt -137.99 159.98 40.58 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 41.6 mttp -89.01 135.4 33.57 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.154 0.502 . . . . 0.0 111.532 -177.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.562 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 21.5 p30 -81.79 -167.26 1.45 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.587 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.705 HD21 ' HB3' ' A' ' 87' ' ' ALA . 91.1 mt -50.33 -35.98 30.08 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.508 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -83.86 -6.54 59.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.718 -176.502 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.85 12.76 70.96 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -173.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -88.06 112.96 23.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.262 -0.469 . . . . 0.0 110.181 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.587 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.0 m -61.88 111.38 1.87 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.154 0.502 . . . . 0.0 111.144 177.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.481 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 14.4 mmt180 -90.64 142.52 27.67 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.55 173.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.536 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 79.6 p -119.22 165.6 14.03 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 171.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.506 HD22 HG11 ' A' ' 38' ' ' VAL . 62.8 mt -79.61 -24.93 41.63 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 p -68.09 -18.26 64.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.938 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -83.3 -41.36 18.37 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.66 0.743 . . . . 0.0 109.449 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.727 HD23 HG13 ' A' ' 38' ' ' VAL . 4.6 tp -76.1 -7.19 54.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.727 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.603 ' NZ ' ' HB3' ' A' ' 34' ' ' LYS . 1.1 ttpm? -61.17 99.83 0.11 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.128 175.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.88 -30.76 0.21 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -174.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.608 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 86.4 mttt -113.2 177.5 4.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 167.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.812 HG23 ' HD1' ' A' ' 69' ' ' PHE . 13.0 m -82.35 130.72 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.727 HG13 HD23 ' A' ' 33' ' ' LEU . 43.6 t -101.72 124.03 55.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.178 0.514 . . . . 0.0 111.751 -167.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.552 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.4 tp -94.28 112.6 24.4 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.765 175.054 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.63 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.4 mm -85.2 105.27 13.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.514 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 29.2 t70 -107.8 110.83 22.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.744 -178.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.44 ' HB3' HD13 ' A' ' 114' ' ' LEU . 36.1 m-85 -95.05 105.18 17.08 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.539 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.6 t -137.56 -175.84 4.2 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.402 0.62 . . . . 0.0 111.563 -170.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.559 HG23 ' HB3' ' A' ' 77' ' ' ASP . 0.2 OUTLIER -143.0 122.39 8.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.782 178.654 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.706 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 49.4 m-85 -81.27 79.97 7.8 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 9.7 t30 174.79 -30.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.846 175.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.498 ' HB2' HG13 ' A' ' 44' ' ' VAL . 38.4 t-20 -66.82 134.53 52.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.507 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.27 -30.87 70.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.305 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.8 tpt -64.29 -30.1 71.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.906 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 m -68.46 -28.27 66.9 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.356 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.91 -53.75 45.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.864 0.364 . . . . 0.0 110.929 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.78 63.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.198 0.523 . . . . 0.0 110.604 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.493 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.1 t60 -65.3 -44.23 88.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.041 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.469 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.6 m-20 -66.3 -27.15 67.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.647 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.44 -55.11 34.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.262 0.553 . . . . 0.0 109.839 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.57 -32.92 73.03 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.845 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.1 mt -64.45 -39.48 93.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.864 176.083 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -62.35 -33.34 74.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.492 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.542 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 2.2 tt0 -71.77 -52.61 16.79 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.815 HD12 HD12 ' A' ' 140' ' ' ILE . 1.5 mm? -51.69 -34.97 40.82 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 112.952 -1.931 . . . . 0.0 111.577 177.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -75.9 -41.52 51.71 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.189 0.518 . . . . 0.0 110.065 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -65.28 -21.43 66.72 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.832 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.611 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 36.3 mttm -80.99 -61.73 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.602 -178.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.428 ' HE1' ' HG3' ' A' ' 141' ' ' LYS . 71.1 m-85 -111.21 -10.91 14.27 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -163.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.597 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.88 -31.31 71.58 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.307 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.5 m -64.18 -24.88 67.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.978 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -96.12 -6.93 37.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.027 0.442 . . . . 0.0 110.67 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.426 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 117.27 64.41 0.33 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.638 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.812 ' HD1' HG23 ' A' ' 37' ' ' VAL . 34.4 t80 -134.44 141.93 46.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.664 ' HG2' HD11 ' A' ' 33' ' ' LEU . 7.9 tp10 -140.24 148.6 41.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.351 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.569 ' HB ' ' CG ' ' A' ' 92' ' ' TRP . 48.0 mt -112.51 124.93 69.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.018 0.437 . . . . 0.0 109.963 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.581 ' CE1' HG21 ' A' ' 95' ' ' VAL . 88.2 t80 -109.86 100.43 9.41 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.514 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.4 mt-30 -92.2 135.43 34.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.092 0.472 . . . . 0.0 111.29 -178.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 68.2 mt -117.95 110.77 31.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.458 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.73 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 34.6 p -85.35 136.95 33.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.689 0.28 . . . . 0.0 111.114 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.462 HD22 ' H ' ' A' ' 101' ' ' ALA . 50.8 mt -105.39 13.74 29.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.812 0.339 . . . . 0.0 110.829 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.73 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 2.2 p-10 -86.47 163.04 17.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.969 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -98.09 -29.06 7.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.768 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.477 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 13.5 t0 -76.45 110.19 10.79 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.397 0.618 . . . . 0.0 110.669 -178.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.604 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 32.1 tt0 -70.93 -19.94 62.52 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.334 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' HIS . . . . . 0.477 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.0 OUTLIER -71.53 -45.04 63.48 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.835 -175.756 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -71.14 -44.95 64.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.977 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.517 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 39.2 t90 -55.9 -42.84 76.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.354 172.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.604 ' HB2' ' O ' ' A' ' 80' ' ' GLU . 11.5 tppt? -60.91 -57.47 12.52 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.96 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 p -65.14 -41.42 94.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.296 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.401 ' HB2' ' HD2' ' A' ' 45' ' ' TYR . 38.2 m -67.69 -37.46 82.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.424 -178.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.705 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -86.58 -17.74 33.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.604 -177.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -50.18 -35.04 24.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.039 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -109.76 16.04 22.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.536 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 87' ' ' ALA . 27.8 mt -89.63 146.88 36.53 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.144 0.497 . . . . 0.0 111.525 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.709 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 93.1 Cg_endo -79.96 -40.49 0.23 Allowed 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 123.694 2.929 . . . . 0.0 114.027 -176.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.709 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.0 p90 -96.15 -168.09 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.783 0.325 . . . . 0.0 111.627 -170.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.411 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 24.8 t -81.61 120.29 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 121.148 0.499 . . . . 0.0 110.528 -171.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 35.0 m -116.3 106.54 13.77 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.956 -176.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.641 HG11 ' HB2' ' A' ' 20' ' ' LEU . 7.9 t -121.29 159.69 23.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.463 -172.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.567 HH12 ' HB2' ' A' ' 80' ' ' GLU . 54.0 ttp180 -120.34 141.78 49.73 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.763 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.527 ' HA ' HD13 ' A' ' 20' ' ' LEU . 30.4 t70 -73.2 160.53 31.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.321 177.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.79 -28.43 33.21 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -174.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.484 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 33.4 t30 -122.49 -12.69 8.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 112.46 -172.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.55 84.72 0.23 Allowed Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.651 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.462 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 75.19 -32.78 0.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.46 0.704 . . . . 0.0 111.926 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.484 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 52.3 m-85 -86.28 37.04 0.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.066 0.46 . . . . 0.0 110.016 176.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.432 ' HB3' HG13 ' A' ' 106' ' ' ILE . 23.1 t -87.22 136.73 32.82 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.346 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.8 m -61.83 -29.25 70.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.06 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -64.79 -41.42 95.84 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.843 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.432 HG13 ' HB3' ' A' ' 103' ' ' SER . 71.7 mt -56.81 -38.78 60.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.165 -178.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 36.1 t -68.91 -28.62 66.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.758 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.43 -26.68 61.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.94 0.4 . . . . 0.0 110.56 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -83.85 -1.55 54.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 68.92 5.21 4.89 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.805 0.812 . . . . 0.0 110.198 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.615 HG11 ' HG ' ' A' ' 114' ' ' LEU . 8.7 t -58.49 119.86 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.882 -174.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 3.4 m -110.12 -4.59 15.72 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.616 174.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -149.41 114.24 5.37 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.343 -176.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.621 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 53.8 mt -118.86 165.6 16.42 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 170.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.621 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.18 158.89 91.82 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.614 0.898 . . . . 0.0 113.582 1.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.1 m -155.22 164.3 38.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.012 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.43 154.05 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.63 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.1 m-85 -132.35 161.86 32.52 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.692 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.4 tp -110.85 131.67 54.85 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.946 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 23.0 t -129.31 127.4 65.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 174.082 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.475 ' HB3' HD22 ' A' ' 143' ' ' LEU . 8.0 p30 -83.78 170.76 13.82 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.029 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -60.81 -12.67 11.54 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 124.272 0.983 . . . . 0.0 113.544 -164.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -95.71 13.46 26.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 34.0 t30 61.01 54.78 3.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.841 -174.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.474 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.9 mm-40 -122.25 137.36 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.54 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 126' ' ' LEU . 10.0 mt -68.49 112.27 5.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 0.0 110.437 175.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.692 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 24.4 m -81.37 -55.02 4.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.005 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -168.33 172.39 8.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.46 -175.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.677 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -93.94 161.88 14.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 108.96 176.001 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.507 ' HA2' HD12 ' A' ' 133' ' ' ILE . . . -48.05 -48.99 24.91 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 114.7 0.64 . . . . 0.0 114.7 -172.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.85 -26.87 59.99 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 117.028 0.414 . . . . 0.0 110.739 -176.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.429 ' ND2' HH21 ' A' ' 129' ' ' ARG . 4.5 m-20 -72.35 -34.18 67.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.877 175.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.888 HG21 ' HG ' ' A' ' 136' ' ' LEU . 49.1 mt -69.46 -40.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.56 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.587 ' HG3' ' C ' ' A' ' 133' ' ' ILE . 0.0 OUTLIER 48.45 -86.51 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.287 0.992 . . . . 0.0 112.023 -173.273 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -88.43 84.78 6.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.093 -176.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.888 ' HG ' HG21 ' A' ' 133' ' ' ILE . 4.6 mp -60.6 -32.53 71.65 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.719 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -52.85 -56.09 18.36 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.812 0.339 . . . . 0.0 110.365 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.33 -41.64 93.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.777 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -58.09 -54.88 42.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.614 -177.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.815 HD12 HD12 ' A' ' 60' ' ' LEU . 35.8 mt -65.35 -35.23 74.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.862 0.363 . . . . 0.0 110.948 -177.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.428 ' HG3' ' HE1' ' A' ' 64' ' ' TYR . 3.5 ttmp? -60.15 -42.52 95.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.156 0.503 . . . . 0.0 109.991 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -82.84 -18.4 40.54 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.861 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 55.7 mt -62.2 -38.42 89.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.419 0.628 . . . . 0.0 109.544 170.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 44.5 mt -84.63 -59.35 2.39 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.158 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -109.81 25.94 11.22 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -171.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -126.19 68.57 0.52 Allowed Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 119.801 -1.19 . . . . 0.0 113.75 -175.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -135.04 120.27 18.92 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.132 0.492 . . . . 0.0 110.558 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -86.01 74.58 10.09 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.369 0.604 . . . . 0.0 111.151 -173.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -138.88 0.64 2.0 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 169.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.472 ' O ' ' HB2' ' A' ' 151' ' ' HIS . 10.9 t-80 -178.25 -65.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.236 -1.347 . . . . 0.0 108.346 -175.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.472 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 52.9 t-80 166.15 -43.5 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 . . . . . 0 C--O 1.25 1.108 0 CA-C-N 113.396 -1.729 . . . . 0.0 107.474 170.144 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.601 0.239 . . . . 0.0 110.785 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.0 t -85.19 -64.47 1.15 Allowed 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.1 tp -79.1 86.47 4.92 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 174.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -107.96 99.75 9.17 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.9 tp -118.83 99.61 51.13 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.555 -175.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -73.95 178.58 6.68 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.688 2.259 . . . . 0.0 112.526 -178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -110.98 95.98 5.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.896 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -141.92 176.45 8.93 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.472 -175.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.417 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -77.07 -174.64 3.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.355 -177.98 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.569 ' O ' ' HB3' ' A' ' 11' ' ' LYS . 50.6 mm -55.28 130.85 17.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 173.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.569 ' HB3' ' O ' ' A' ' 10' ' ' ILE . 38.8 tttm 76.18 77.92 0.09 Allowed 'General case' 0 N--CA 1.465 0.286 0 O-C-N 124.021 0.826 . . . . 0.0 109.851 -171.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 9' ' ' LYS . 0.5 OUTLIER -96.21 -161.37 0.86 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.804 178.871 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 62.25 12.46 5.18 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.19 174.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.6 m -86.2 2.17 47.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.254 0.55 . . . . 0.0 110.478 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.502 HD13 HG11 ' A' ' 120' ' ' VAL . 4.9 tp -159.96 139.57 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.991 -179.09 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.416 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.1 mp -94.39 102.73 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 168.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.92 132.47 44.4 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.403 ' H ' ' HG ' ' A' ' 30' ' ' LEU . 8.4 mt -113.61 105.54 18.94 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.25 -176.308 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.0 OUTLIER -93.88 101.44 13.52 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.267 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.507 ' HB2' HG11 ' A' ' 95' ' ' VAL . 78.4 mt -137.54 155.66 48.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.4 mtmt -89.0 137.99 31.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.495 0.664 . . . . 0.0 111.425 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.619 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -87.64 -169.89 2.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.87 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.677 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 36.5 tp -48.33 -39.52 22.27 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.603 0.761 . . . . 0.0 112.716 -178.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.9 mtmm -74.98 -13.6 60.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.999 0.428 . . . . 0.0 111.738 -177.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.63 17.25 55.17 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 -175.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.445 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 4.0 m-20 -99.56 127.56 45.64 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.5 m -67.97 113.78 5.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.491 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 16.5 mmm180 -92.45 142.29 27.58 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.441 ' O ' ' HB3' ' A' ' 32' ' ' ASP . 2.0 m -134.31 163.66 29.15 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 174.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.487 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 65.4 mt -80.08 -32.88 39.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.553 -172.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.7 p -64.21 -14.32 54.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.018 0.437 . . . . 0.0 111.116 173.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t0 -82.6 -45.07 15.03 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -76.35 0.13 20.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.473 -1.24 . . . . 0.0 110.659 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.5 ' HA ' HD22 ' A' ' 124' ' ' ASN . 7.4 ttpm? -58.26 134.58 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.736 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.69 -29.88 5.5 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -174.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.581 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 61.4 mttm -112.38 166.15 11.55 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.761 HG23 ' HD1' ' A' ' 69' ' ' PHE . 8.5 m -84.27 124.44 39.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.626 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 99.4 t -102.06 132.03 48.86 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 121.641 0.734 . . . . 0.0 111.045 -169.424 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.645 HD22 HG23 ' A' ' 71' ' ' ILE . 6.4 tt -94.38 104.27 16.25 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 172.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.441 HG13 ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -88.46 104.34 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.281 178.339 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.571 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.2 t70 -103.26 142.02 34.9 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.065 -175.111 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -124.3 95.93 4.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 173.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.442 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.7 t -123.7 -175.71 3.28 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.296 -174.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.561 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -137.78 111.51 8.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.08 0.467 . . . . 0.0 110.628 178.85 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.492 ' CD1' ' HB2' ' A' ' 75' ' ' SER . 41.7 m-85 -72.55 79.18 1.06 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 51.4 t30 172.51 -25.59 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.224 -177.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.561 ' HB2' HG13 ' A' ' 44' ' ' VAL . 5.6 t-20 -82.29 150.15 27.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.643 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.02 -30.95 62.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -71.77 -20.17 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.75 -176.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.0 m -63.97 -24.69 67.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.623 0.249 . . . . 0.0 111.329 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.05 -50.23 74.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.802 0.334 . . . . 0.0 111.269 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.61 -31.94 60.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.103 0.478 . . . . 0.0 110.814 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.41 ' HE2' ' CG ' ' A' ' 41' ' ' ASP . 86.3 t60 -63.72 -45.11 91.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.715 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.409 HD21 ' N ' ' A' ' 54' ' ' ASN . 0.9 OUTLIER -71.71 -18.78 62.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.836 -176.033 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -73.85 -44.31 55.92 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.95 -37.77 77.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.395 0.616 . . . . 0.0 109.882 175.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.87 -40.31 91.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.926 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.478 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 13.1 tpt180 -56.14 -35.96 67.72 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.958 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.55 -50.96 11.49 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -172.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.912 HD12 HD12 ' A' ' 140' ' ' ILE . 1.9 mm? -55.97 -31.34 62.9 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 113.262 -1.79 . . . . 0.0 111.441 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.416 ' HD1' HG13 ' A' ' 71' ' ' ILE . 23.9 t80 -82.83 -44.03 15.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.387 0.613 . . . . 0.0 109.876 -178.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 29.1 t30 -60.65 -24.82 65.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.116 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -85.95 -60.67 1.95 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.815 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.57 -12.51 16.4 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -164.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.552 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.41 -31.77 70.7 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -174.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 m -60.35 -28.73 68.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.168 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.555 ' HG3' HD13 ' A' ' 144' ' ' LEU . 9.2 pt20 -108.68 29.77 7.12 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 99.02 48.62 1.71 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.067 -1.063 . . . . 0.0 112.852 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.761 ' HD1' HG23 ' A' ' 37' ' ' VAL . 37.3 t80 -132.23 140.5 48.7 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.426 ' OE1' HG23 ' A' ' 93' ' ' VAL . 0.3 OUTLIER -140.62 151.2 44.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.493 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.645 HG23 HD22 ' A' ' 39' ' ' LEU . 65.2 mt -114.24 111.0 34.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.714 0.769 . . . . 0.0 110.394 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.537 ' CE1' HG21 ' A' ' 95' ' ' VAL . 91.5 t80 -96.56 99.17 10.82 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.571 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 52.1 tt0 -100.96 114.35 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.349 -171.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.413 HD11 ' HE2' ' A' ' 72' ' ' TYR . 50.0 mt -96.71 124.6 49.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.218 177.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.492 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 27.9 t -96.93 137.95 35.23 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.904 0.383 . . . . 0.0 110.472 177.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 31.0 mt -112.08 34.32 4.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.653 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.421 ' OD2' ' HD3' ' A' ' 96' ' ' ARG . 3.6 p30 -82.92 -176.16 6.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.449 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.7 35.98 1.88 Allowed Glycine 0 N--CA 1.444 -0.773 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.45 176.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -145.35 115.83 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.359 0.599 . . . . 0.0 110.995 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.505 ' HA ' HH12 ' A' ' 96' ' ' ARG . 4.9 tp10 -64.65 -36.0 82.84 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.096 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -61.51 -56.38 20.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.585 -170.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -68.55 -41.05 80.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.76 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.677 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 53.2 t90 -60.81 -55.12 36.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.545 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.412 ' HE2' HD12 ' A' ' 23' ' ' LEU . 2.6 ttmt -57.32 -46.93 82.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.899 0.381 . . . . 0.0 111.362 -176.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 21.3 m -70.2 -42.47 72.3 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.804 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.6 t -75.43 -42.38 53.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.05 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.601 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -64.59 -32.13 73.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.863 0.363 . . . . 0.0 110.99 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.53 -27.84 68.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.413 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.61 -1.99 42.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.528 -176.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.476 HD12 ' OH ' ' A' ' 45' ' ' TYR . 26.8 mt -96.7 148.59 34.66 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 121.171 0.51 . . . . 0.0 112.229 -176.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.618 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 89.4 Cg_endo -74.41 -51.79 0.13 Allowed 'Trans proline' 0 N--CA 1.478 0.611 0 C-N-CA 124.128 3.219 . . . . 0.0 114.423 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.618 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -83.57 -178.95 7.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.627 -172.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.426 HG23 ' OE1' ' A' ' 70' ' ' GLU . 99.1 t -70.2 125.19 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 121.294 0.568 . . . . 0.0 111.052 -173.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.601 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 1.8 p -113.97 105.21 12.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.396 -176.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.619 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 1.7 t -115.36 161.51 14.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.379 -172.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.505 HH12 ' HA ' ' A' ' 80' ' ' GLU . 46.9 ttp180 -140.49 140.12 35.25 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.255 170.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -93.94 149.33 21.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.63 175.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.65 -1.75 47.84 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -173.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -110.01 -12.49 14.53 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.106 -0.371 . . . . 0.0 111.702 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.21 -117.1 8.66 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.119 -178.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -91.63 25.15 2.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.86 0.362 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -130.22 17.27 5.52 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.419 178.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.543 ' HB2' HG13 ' A' ' 106' ' ' ILE . 10.5 m -61.96 134.55 56.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.204 -178.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 4.0 m -55.78 -35.22 66.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.012 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -57.08 -47.56 80.72 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.543 HG13 ' HB2' ' A' ' 103' ' ' SER . 68.2 mt -57.93 -37.76 62.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.928 -177.449 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 16.0 m -70.33 -36.19 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.898 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.5 mt -66.01 -34.87 79.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.305 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -71.44 -29.75 65.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.667 0.27 . . . . 0.0 110.853 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.7 77.68 0.29 Allowed 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -163.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.445 HG11 ' CG2' ' A' ' 106' ' ' ILE . 7.4 p -90.49 152.93 3.27 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.491 -174.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 8.6 m -72.99 -43.4 62.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 173.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASN . . . . . 0.423 ' H ' HG22 ' A' ' 111' ' ' VAL . 2.4 p-10 174.84 169.83 0.27 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.154 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 3.6 mm? -118.96 162.26 32.22 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.547 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.7 Cg_endo -73.36 153.5 99.17 Favored 'Cis proline' 0 C--N 1.35 0.607 0 C-N-CA 123.811 -1.329 . . . . 0.0 113.163 0.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.431 ' HB2' HD13 ' A' ' 114' ' ' LEU . 30.4 m -151.13 178.57 9.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.383 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.617 HG12 ' HA3' ' A' ' 130' ' ' GLY . 4.3 p -139.36 162.21 27.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.441 ' HB2' HG13 ' A' ' 40' ' ' ILE . 91.6 m-85 -144.27 157.17 44.42 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.871 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.7 tp -112.77 144.92 41.48 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.079 -0.248 . . . . 0.0 110.681 -177.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 126' ' ' LEU . 5.1 m -141.67 140.5 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 120.853 0.359 . . . . 0.0 110.9 169.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.63 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 5.3 p30 -80.49 173.83 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.603 ' HG3' HG13 ' A' ' 37' ' ' VAL . 98.2 mtt180 -52.55 -30.03 28.53 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.147 1.165 . . . . 0.0 114.147 -171.002 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -76.79 4.93 8.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.094 0.474 . . . . 0.0 110.243 177.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.5 HD22 ' HA ' ' A' ' 34' ' ' LYS . 3.2 m-80 58.44 61.95 2.11 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.221 -173.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.63 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 46.1 mt-10 -124.94 132.18 53.32 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.85 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.643 ' HA ' HG12 ' A' ' 120' ' ' VAL . 1.2 tt -58.91 113.39 2.05 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 123.895 0.747 . . . . 0.0 110.504 -174.146 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.871 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.6 m -77.88 -55.29 5.43 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.581 -179.294 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.56 ' HB3' HD11 ' A' ' 133' ' ' ILE . . . -172.71 171.48 4.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.299 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.732 ' HB2' ' ND2' ' A' ' 132' ' ' ASN . 57.9 mtt180 -90.48 144.91 25.33 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.11 -178.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.617 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -64.48 -17.77 62.55 Favored Glycine 0 C--N 1.319 -0.387 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 172.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.622 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 10.9 mt-10 -64.94 -24.71 67.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.099 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.732 ' ND2' ' HB2' ' A' ' 129' ' ' ARG . 4.2 p30 -118.49 -23.14 7.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.562 179.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.56 HD11 ' HB3' ' A' ' 128' ' ' ALA . 70.5 mt -79.41 101.85 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.919 0.39 . . . . 0.0 110.461 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.474 ' H ' ' HG2' ' A' ' 134' ' ' LYS . 11.3 ptmm? -84.76 -32.35 23.47 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -121.61 93.29 3.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.538 ' O ' HG13 ' A' ' 140' ' ' ILE . 5.8 mp -75.85 -25.52 56.29 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.228 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.574 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.1 t70 -49.37 -58.01 5.88 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 123.433 0.458 . . . . 0.0 110.931 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -60.7 -42.98 98.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.813 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -57.81 -53.1 61.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.456 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.912 HD12 HD12 ' A' ' 60' ' ' LEU . 33.7 mt -64.54 -40.56 89.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.889 0.376 . . . . 0.0 110.949 -178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 145' ' ' GLU . 26.9 ttpp -58.92 -47.28 85.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.436 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.638 ' HA ' ' HG2' ' A' ' 145' ' ' GLU . 32.3 mtmt -68.41 -20.47 64.67 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.766 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 87.5 mt -72.8 -40.81 65.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.263 0.554 . . . . 0.0 110.239 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.555 HD13 ' HG3' ' A' ' 67' ' ' GLN . 97.6 mt -79.02 -44.04 23.04 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.334 -176.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.638 ' HG2' ' HA ' ' A' ' 142' ' ' LYS . 11.0 pt-20 -64.81 -38.06 89.73 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.99 -178.12 40.95 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.83 176.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -75.53 -23.12 56.61 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 175.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -108.94 90.75 3.39 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 172.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -51.92 107.3 0.19 Allowed 'General case' 0 N--CA 1.464 0.256 0 O-C-N 123.791 0.682 . . . . 0.0 111.673 -176.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -89.87 88.66 7.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.046 -176.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 70.39 8.92 6.81 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.288 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' HIS . . . . . 0.413 ' CE1' ' HA ' ' A' ' 145' ' ' GLU . 3.0 p80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.524 -0.751 . . . . 0.0 109.916 175.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.482 1.136 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.3 t -116.57 -150.02 0.45 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 173.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.0 tp -91.08 67.65 5.98 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 173.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.599 ' HG2' HD13 ' A' ' 5' ' ' ILE . 2.4 pt-20 -87.15 5.08 39.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.285 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.599 HD13 ' HG2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -128.06 101.63 22.44 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.778 179.195 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.535 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 11.9 Cg_exo -72.55 -132.7 0.01 OUTLIER 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.874 2.383 . . . . 0.0 112.9 174.036 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.515 ' OE1' ' HB3' ' A' ' 14' ' ' SER . 4.9 mm-40 62.91 32.38 15.74 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 122.229 1.014 . . . . 0.0 108.616 -172.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.418 ' OD2' ' HB2' ' A' ' 12' ' ' GLU . 7.4 p-10 -87.44 95.81 10.15 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 113.821 -1.536 . . . . 0.0 111.743 -173.188 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.445 ' HE2' ' HB2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER 44.9 130.91 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 179.673 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.1 mt 52.68 -107.5 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.544 -1.207 . . . . 0.0 109.233 -171.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.581 ' HD2' ' HB2' ' A' ' 14' ' ' SER . 24.9 mmtm -156.93 83.05 0.94 Allowed 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 123.82 0.848 . . . . 0.0 110.09 172.154 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 61.3 mm-40 -91.86 -92.87 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.436 0.636 . . . . 0.0 111.061 -178.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.35 14.3 4.54 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.725 175.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.581 ' HB2' ' HD2' ' A' ' 11' ' ' LYS . 0.9 OUTLIER -90.21 -158.66 0.55 Allowed 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 114.701 -1.136 . . . . 0.0 109.89 -176.61 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.613 HD11 HD13 ' A' ' 30' ' ' LEU . 4.9 tp -94.87 124.36 47.34 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.306 175.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.467 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.4 mp -66.55 120.04 12.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.66 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.66 107.69 4.63 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.057 0.456 . . . . 0.0 110.017 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.678 ' O ' ' HA ' ' A' ' 29' ' ' SER . 12.9 mt -106.18 110.3 30.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.872 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.548 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 95.1 mt-30 -107.47 101.4 10.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.122 0.486 . . . . 0.0 111.33 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.59 ' HB2' HG11 ' A' ' 95' ' ' VAL . 28.4 mt -137.19 157.99 45.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.721 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 47.9 mttm -94.8 158.95 15.27 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.391 0.615 . . . . 0.0 111.675 -175.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -95.44 -169.74 2.03 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.39 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.775 HD11 ' HB1' ' A' ' 87' ' ' ALA . 6.4 mp -52.97 -41.5 64.62 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.6 0.562 . . . . 0.0 111.844 -176.538 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 67.5 mttm -81.3 -16.62 51.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.1 -175.061 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.47 6.88 40.81 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.959 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.415 ' OD1' ' HB2' ' A' ' 24' ' ' LYS . 2.4 m120 -80.99 126.36 31.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.3 m -74.86 112.82 11.47 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.959 0.409 . . . . 0.0 110.637 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HG3' HG13 ' A' ' 93' ' ' VAL . 3.6 mmm-85 -100.49 143.47 30.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.678 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.2 p -127.42 175.93 7.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.278 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.613 HD13 HD11 ' A' ' 15' ' ' ILE . 97.2 mt -78.9 -10.95 59.97 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.632 ' HA ' ' HB2' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -88.46 2.27 53.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.334 169.524 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.476 ' HB2' ' H ' ' A' ' 29' ' ' SER . 29.1 t70 -95.94 -33.51 12.15 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.91 HD13 HG21 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -111.47 18.24 19.33 Favored 'General case' 0 C--O 1.249 1.073 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.762 173.298 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.632 ' HB2' ' HA ' ' A' ' 31' ' ' THR . 56.4 tttp -70.93 66.64 0.38 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.202 179.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.41 -23.63 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.032 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.863 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.735 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -137.76 -174.41 3.77 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.95 174.62 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.748 HG22 ' H ' ' A' ' 122' ' ' ARG . 54.6 t -72.17 118.27 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -176.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.91 HG21 HD13 ' A' ' 33' ' ' LEU . 78.0 t -117.55 132.46 67.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-O 122.038 0.923 . . . . 0.0 113.257 -168.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.562 ' HB3' HG23 ' A' ' 71' ' ' ILE . 2.2 tt -81.14 123.49 28.47 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.274 171.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.588 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 5.6 mm -99.42 105.54 17.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 173.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.484 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 16.5 t70 -108.55 132.69 53.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.025 0.44 . . . . 0.0 111.582 -175.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.639 ' HB3' HD21 ' A' ' 114' ' ' LEU . 62.8 m-85 -121.64 109.82 15.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.529 174.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 t -150.06 176.82 10.45 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.695 HG23 ' HB2' ' A' ' 47' ' ' ASN . 17.8 m -119.59 113.27 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.64 175.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.812 ' CD1' ' HB2' ' A' ' 75' ' ' SER . 33.6 m-85 -67.72 84.77 0.2 Allowed 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.673 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 57.2 t30 174.04 -35.65 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.098 0.951 . . . . 0.0 109.228 -172.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.695 ' HB2' HG23 ' A' ' 44' ' ' VAL . 9.4 t-20 -85.07 143.09 29.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.265 -172.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.55 69.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.367 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.8 mtp -65.56 -24.33 67.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.184 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -81.47 -23.87 37.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.562 -176.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.58 -56.9 14.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.844 0.354 . . . . 0.0 110.827 -178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.78 -27.46 65.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.597 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.6 t60 -66.7 -45.64 78.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.614 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.503 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.4 m-20 -67.05 -27.91 67.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.23 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -61.13 -56.22 23.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.133 0.492 . . . . 0.0 109.896 176.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.43 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . -59.43 -33.38 71.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.021 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 96.3 mt -63.34 -40.8 98.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 110.136 176.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.865 HH21 ' HD3' ' A' ' 91' ' ' PRO . 14.5 ttm180 -64.89 -29.94 70.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.048 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -74.01 -51.82 14.69 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.473 ' CD1' ' HB3' ' A' ' 136' ' ' LEU . 22.7 mt -55.71 -35.91 66.6 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 111.742 -2.481 . . . . 0.0 111.336 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -73.02 -48.36 36.93 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.684 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -62.56 -22.35 66.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.637 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -79.32 -57.65 3.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.135 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.466 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 84.7 m-85 -112.6 -8.68 13.81 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -164.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.568 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.48 -43.0 83.74 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -173.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.4 m -67.84 -16.23 64.0 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.755 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.466 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.1 mp0 -93.88 -0.53 55.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 110.736 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.69 50.6 0.52 Allowed Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.498 -0.858 . . . . 0.0 111.814 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.568 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 80.8 t80 -130.45 136.14 48.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.122 0.487 . . . . 0.0 110.749 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.735 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.5 tp10 -135.7 159.94 40.08 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.461 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 39' ' ' LEU . 48.5 mt -131.0 130.15 63.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.007 0.432 . . . . 0.0 110.231 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.842 ' HB2' HD21 ' A' ' 33' ' ' LEU . 77.1 t80 -117.79 101.17 8.1 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.484 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 57.8 tt0 -105.8 121.52 44.21 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.303 -172.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.426 HD11 ' HE2' ' A' ' 72' ' ' TYR . 60.0 mt -101.88 130.31 51.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.421 -178.24 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.812 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 35.7 t -102.99 112.33 25.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.128 172.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.809 HD11 HD22 ' A' ' 114' ' ' LEU . 2.3 pp -113.22 28.47 8.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.89 0.376 . . . . 0.0 111.201 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.547 ' HB2' ' HB ' ' A' ' 44' ' ' VAL . 19.0 t70 -65.89 -73.91 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.319 176.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.35 -27.58 1.68 Allowed Glycine 0 N--CA 1.44 -1.041 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.892 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -85.67 131.34 34.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.24 0.543 . . . . 0.0 111.572 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -79.14 -38.97 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.52 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -68.96 -39.97 79.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.858 -165.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -77.97 -34.73 50.84 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 -176.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.598 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 22.7 t90 -62.19 -57.6 10.89 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.604 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -64.54 -38.91 92.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.928 -0.309 . . . . 0.0 111.691 -171.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -67.18 -43.53 81.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.999 0.428 . . . . 0.0 110.977 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.566 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.9 m -70.55 -24.37 62.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.811 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.775 ' HB1' HD11 ' A' ' 23' ' ' LEU . . . -87.8 -25.66 23.24 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.506 0.669 . . . . 0.0 110.099 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.3 -13.63 62.24 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.572 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -103.36 -3.49 25.45 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.832 174.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 86' ' ' SER . 41.4 mt -94.03 148.94 36.1 Favored Pre-proline 0 N--CA 1.447 -0.622 0 CA-C-O 121.361 0.6 . . . . 0.0 111.649 -175.313 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.865 ' HD3' HH21 ' A' ' 58' ' ' ARG . 24.7 Cg_endo -90.54 -37.95 0.05 OUTLIER 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 124.156 3.237 . . . . 0.0 113.875 -173.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.653 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.8 p90 -87.57 -169.05 2.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.206 -171.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.557 HG13 ' HG3' ' A' ' 28' ' ' ARG . 38.0 t -78.89 99.39 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-O 121.087 0.47 . . . . 0.0 110.112 -173.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.599 ' HB2' HD11 ' A' ' 23' ' ' LEU . 22.1 m -97.57 113.19 24.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.603 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.62 HG21 ' CE1' ' A' ' 72' ' ' TYR . 1.9 t -119.45 153.19 22.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.511 -170.343 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.463 ' HB2' ' CE2' ' A' ' 83' ' ' TRP . 7.8 tmm_? -124.02 140.0 53.4 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.456 ' HA ' HD13 ' A' ' 20' ' ' LEU . 16.1 t70 -81.92 158.61 23.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 -173.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.36 -34.53 31.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.028 -175.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.32 -12.66 8.59 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.159 -174.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 80.27 -120.17 5.12 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.688 175.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.09 -6.17 32.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 111.55 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -104.15 16.97 25.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.133 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.486 ' HB3' HG13 ' A' ' 106' ' ' ILE . 24.2 t -65.08 133.1 50.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.49 -178.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.484 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 12.0 m -62.53 -26.91 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.186 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.459 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 88.5 m-85 -63.53 -42.63 98.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.982 0.42 . . . . 0.0 110.019 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.797 HG23 HG23 ' A' ' 111' ' ' VAL . 52.3 mt -52.94 -42.27 43.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.999 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.8 m -71.93 -20.39 61.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.341 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 104' ' ' SER . 97.6 mt -81.2 -38.48 26.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.661 0.267 . . . . 0.0 111.406 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.575 ' HB2' HG22 ' A' ' 111' ' ' VAL . 77.3 m-85 -79.55 -25.21 41.72 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.882 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 90.12 23.2 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.065 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.797 HG23 HG23 ' A' ' 106' ' ' ILE . 3.3 m -85.14 148.02 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.268 -1.787 . . . . 0.0 109.691 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 9.0 t -155.1 20.54 0.43 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.943 0.401 . . . . 0.0 111.07 -177.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -146.01 -62.0 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.949 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.809 HD22 HD11 ' A' ' 76' ' ' LEU . 2.4 mp 69.95 169.77 0.11 Allowed Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.473 -177.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.519 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 3.9 Cg_exo -72.38 166.86 79.03 Favored 'Cis proline' 0 C--N 1.353 0.801 0 C-N-CA 123.712 -1.37 . . . . 0.0 111.914 -0.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.4 m -145.17 157.32 44.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.89 -177.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.548 ' O ' ' HA3' ' A' ' 130' ' ' GLY . 1.3 p -134.98 155.43 38.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.588 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 89.7 m-85 -145.56 153.57 41.23 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.856 ' HB3' ' HB3' ' A' ' 127' ' ' SER . 8.5 tp -122.07 150.35 42.26 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.488 -1.285 . . . . 0.0 112.217 -178.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.58 HG12 ' HA ' ' A' ' 126' ' ' LEU . 13.7 m -136.93 143.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.749 169.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.582 ' HB3' HD22 ' A' ' 143' ' ' LEU . 5.0 p30 -110.48 153.79 24.55 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.748 ' H ' HG22 ' A' ' 37' ' ' VAL . 21.4 ttp-105 49.8 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.785 1.303 . . . . 0.0 113.173 167.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.401 ' H ' ' HB3' ' A' ' 122' ' ' ARG . 9.4 m120 -97.56 30.54 2.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.768 -176.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.567 ' CB ' ' HG3' ' A' ' 34' ' ' LYS . 1.2 t-20 58.68 53.88 5.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.998 -178.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.569 ' HG3' ' ND2' ' A' ' 121' ' ' ASN . 1.6 pt-20 -109.08 128.73 55.24 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.379 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.58 ' HA ' HG12 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -52.07 116.4 2.17 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.688 0.618 . . . . 0.0 111.192 -173.619 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.856 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 24.8 t -71.76 -61.56 1.74 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.663 178.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.11 164.34 18.04 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.771 179.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.553 ' HB3' ' OE1' ' A' ' 131' ' ' GLU . 7.3 mmm180 -75.37 147.5 39.98 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.001 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 1.048 ' HA2' HG12 ' A' ' 133' ' ' ILE . . . -67.33 -21.74 72.43 Favored Glycine 0 CA--C 1.508 -0.385 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.985 -175.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.553 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.9 mp0 -67.1 -12.39 59.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.361 0.601 . . . . 0.0 109.547 173.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -117.62 -1.53 11.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.163 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 1.048 HG12 ' HA2' ' A' ' 130' ' ' GLY . 16.5 mm -84.39 94.79 3.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.411 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 14.7 ptmm? -50.27 -51.78 41.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.383 0.611 . . . . 0.0 110.206 176.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.411 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 4.8 m-20 -144.35 126.64 15.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.927 HD22 HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.85 -38.86 79.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.144 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.412 ' HB2' HD21 ' A' ' 60' ' ' LEU . 9.5 t70 -49.09 -58.42 4.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.771 176.064 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.01 -40.96 70.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.414 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.616 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.914 -175.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.705 HD11 HD12 ' A' ' 136' ' ' LEU . 24.1 mt -60.64 -46.08 96.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.691 0.758 . . . . 0.0 110.037 176.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.447 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 17.2 ttpt -56.99 -39.09 74.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.559 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.569 ' HE3' ' HA ' ' A' ' 139' ' ' ALA . 17.9 pttp -84.39 -19.94 32.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.526 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 13.8 mt -81.52 -29.56 33.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -175.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 87.0 mt -52.64 -42.14 64.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.356 0.598 . . . . 0.0 110.179 178.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.484 ' HB3' ' ND1' ' A' ' 151' ' ' HIS . 18.7 mm-40 -86.46 15.06 5.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.916 178.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.52 -63.13 1.48 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.64 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 77.41 -6.95 1.92 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.021 0.928 . . . . 0.0 112.715 171.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 8.0 p80 -126.81 105.88 8.96 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.823 -0.751 . . . . 0.0 111.617 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 81.8 t60 70.92 -9.2 0.86 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.461 174.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -157.09 144.39 18.74 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.484 ' ND1' ' HB3' ' A' ' 145' ' ' GLU . 0.1 OUTLIER -92.1 -93.28 0.15 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 175.525 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 152' ' ' HIS . . . . . 0.452 ' H ' ' HB3' ' A' ' 151' ' ' HIS . 4.5 p-80 . . . . . 0 C--O 1.244 0.771 0 CA-C-O 118.315 -0.85 . . . . 0.0 108.916 173.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.485 0.183 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.5 m -160.14 -78.49 0.06 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.81 0.338 . . . . 0.0 111.071 -177.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -125.82 43.15 3.14 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.522 -173.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -84.15 18.11 2.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.849 0.356 . . . . 0.0 111.008 177.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 22.6 pt -66.9 117.44 45.44 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.412 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.458 ' HD2' ' OE1' ' A' ' 7' ' ' GLU . 84.0 Cg_endo -81.97 4.97 6.63 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.493 2.129 . . . . 0.0 114.406 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.458 ' OE1' ' HD2' ' A' ' 6' ' ' PRO . 2.9 pm0 -85.67 46.07 1.27 Allowed 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 121.26 0.552 . . . . 0.0 110.539 177.156 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -76.27 80.68 3.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.987 -177.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? 62.37 -172.0 0.16 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.97 -1.014 . . . . 0.0 112.373 176.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.0 mt 64.9 -100.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.888 176.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.597 ' HD2' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -157.07 8.12 0.18 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.944 0.878 . . . . 0.0 109.289 -175.746 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.44 ' O ' ' HA ' ' A' ' 7' ' ' GLU . 14.3 mm-40 -80.84 147.18 30.53 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.048 -168.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.34 -99.42 0.1 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.35 -171.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m 60.6 17.04 7.06 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.255 0.55 . . . . 0.0 111.449 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.579 HG21 ' O ' ' A' ' 124' ' ' ASN . 9.0 pt -93.66 177.27 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.116 -178.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.443 HG21 ' HD1' ' A' ' 105' ' ' TYR . 63.9 mt -111.2 104.59 17.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.65 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.1 107.38 8.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.475 0.655 . . . . 0.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.605 ' O ' ' HA ' ' A' ' 29' ' ' SER . 28.4 mm -83.38 126.0 40.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.622 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.639 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 38.5 mt-30 -129.45 95.27 3.97 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.822 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.559 HD22 ' C ' ' A' ' 19' ' ' GLN . 1.1 mm? -129.58 159.95 34.79 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.198 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.5 mtmt -85.68 143.8 28.18 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.093 0.473 . . . . 0.0 110.453 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.506 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 23.2 p30 -80.72 -171.13 2.97 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.457 -178.307 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.656 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 3.3 tm? -50.51 -41.27 53.3 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.187 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -75.73 -41.63 52.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.986 0.422 . . . . 0.0 110.977 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 15.65 2.42 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.645 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.454 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 15.5 m120 -87.92 118.05 27.2 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.8 m -64.59 107.52 1.42 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.201 0.524 . . . . 0.0 110.032 177.067 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.639 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 9.4 mmt180 -92.26 135.41 34.03 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.505 176.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.605 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 69.8 p -112.78 158.23 20.37 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 169.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.455 HD22 HG11 ' A' ' 38' ' ' VAL . 81.9 mt -68.1 -28.43 67.34 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.603 ' HA ' ' OD1' ' A' ' 124' ' ' ASN . 5.8 p -66.56 -17.14 64.65 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.037 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -81.85 -23.14 36.58 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.846 0.831 . . . . 0.0 109.171 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.62 HD23 HG13 ' A' ' 38' ' ' VAL . 2.4 tp -96.57 2.1 51.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.119 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -57.23 112.69 1.45 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.961 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.2 -41.97 1.12 Allowed Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 60.7 mttp -100.53 171.04 7.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.675 HG23 ' HD1' ' A' ' 69' ' ' PHE . 11.5 m -81.92 124.65 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 170.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.62 HG13 HD23 ' A' ' 33' ' ' LEU . 47.5 t -101.64 120.06 50.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.743 -170.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.582 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.5 tp -85.94 110.1 19.21 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.622 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 26.8 mm -84.38 105.12 13.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.509 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 10.3 t70 -108.52 110.65 22.2 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.68 -177.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.576 ' HB3' HD13 ' A' ' 114' ' ' LEU . 26.3 m-85 -98.23 100.31 11.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.781 174.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.485 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -136.27 -174.78 3.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.472 -176.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.635 ' CG1' ' HB3' ' A' ' 47' ' ' ASN . 12.0 p -133.18 133.03 58.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 177.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 1.026 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 42.4 m-85 -87.67 78.83 8.4 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -176.25 -38.55 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.849 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.635 ' HB3' ' CG1' ' A' ' 44' ' ' VAL . 5.0 t30 -90.07 133.24 34.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.519 -174.23 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.49 -22.39 32.33 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.987 -173.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.7 mtt -56.86 -30.36 63.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.868 0.366 . . . . 0.0 110.85 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.0 t -73.06 -23.03 60.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.949 -177.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.7 -58.78 5.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.797 0.332 . . . . 0.0 111.167 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.61 -31.42 68.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.26 0.552 . . . . 0.0 110.457 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.428 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.3 t60 -60.01 -41.7 92.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.726 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.6 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.2 m-20 -71.29 -20.91 62.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.795 -179.101 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.7 tt -72.47 -43.32 63.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.93 -37.35 82.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.384 0.612 . . . . 0.0 110.041 175.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 54' ' ' ASN . 91.0 mt -65.19 -41.43 94.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.805 176.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -57.49 -32.06 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.84 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.68 -55.44 5.65 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.795 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.61 -32.41 63.08 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.757 -2.019 . . . . 0.0 111.23 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -74.47 -47.86 30.87 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.223 0.535 . . . . 0.0 109.852 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -64.65 -20.75 66.48 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.685 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -78.82 -60.46 2.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.989 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.524 ' HB3' HD11 ' A' ' 144' ' ' LEU . 92.3 m-85 -114.29 -5.93 12.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 113.939 1.089 . . . . 0.0 113.939 -164.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.55 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -55.36 -38.05 68.31 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.299 0.499 . . . . 0.0 111.964 -175.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.2 p -66.65 -16.38 64.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.031 -176.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.483 ' HB2' HD13 ' A' ' 144' ' ' LEU . 3.6 mm-40 -96.65 4.45 51.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.793 0.33 . . . . 0.0 110.758 -174.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.87 45.78 1.25 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.622 -176.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.675 ' HD1' HG23 ' A' ' 37' ' ' VAL . 41.9 t80 -125.96 135.34 51.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.748 0.309 . . . . 0.0 110.3 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -140.43 147.5 39.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.971 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' A' ' 92' ' ' TRP . 55.8 mt -107.97 129.91 61.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.044 0.45 . . . . 0.0 110.082 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.417 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 83.1 t80 -110.8 99.83 8.68 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.509 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 19.3 tt0 -100.59 123.3 44.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.929 -173.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.407 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 27.6 mt -110.38 127.22 67.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.302 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . 1.026 ' HB3' ' HD1' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -84.97 141.52 30.29 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.177 0.298 . . . . 0.0 110.301 172.3 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.534 HD11 ' CD1' ' A' ' 114' ' ' LEU . 47.3 mt -96.0 -3.46 44.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 111.058 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.457 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 5.8 p-10 -90.36 -170.57 2.79 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.433 -174.444 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -136.47 29.18 2.81 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 173.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.33 125.88 41.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.882 0.372 . . . . 0.0 110.237 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.2 -43.87 23.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.66 -177.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.7 p80 -69.05 -42.95 75.61 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.162 -166.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -79.12 -38.23 36.63 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.278 -177.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.656 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 31.5 t90 -61.64 -51.25 69.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.06 0.457 . . . . 0.0 109.979 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.615 ' HA ' HD21 ' A' ' 23' ' ' LEU . 50.2 tttm -63.08 -52.85 61.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.219 -175.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.7 m -59.1 -35.17 72.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.995 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.477 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 24.2 t -85.17 -43.29 13.96 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.262 -178.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.601 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -80.67 -25.1 38.45 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -171.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -57.9 -31.86 67.16 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.824 0.345 . . . . 0.0 111.837 -175.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -109.29 13.98 24.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.467 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.496 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 17.9 mt -76.95 148.71 79.22 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.281 0.562 . . . . 0.0 111.937 -177.192 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.69 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -73.21 -41.5 1.26 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.648 2.899 . . . . 0.0 113.233 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.69 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.1 p90 -95.35 -171.72 2.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.837 0.351 . . . . 0.0 111.466 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.8 t -82.94 132.99 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.152 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.601 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 3.9 p -130.93 110.6 11.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -176.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.506 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 15.6 m -123.53 162.02 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.421 ' O ' HD12 ' A' ' 20' ' ' LEU . 52.4 ttp180 -124.03 129.87 51.63 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.136 -0.625 . . . . 0.0 112.271 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -106.5 111.29 23.78 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 171.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -71.22 -2.19 15.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.964 0.411 . . . . 0.0 111.318 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -103.35 10.05 37.63 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.23 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.505 ' HA3' ' HB3' ' A' ' 76' ' ' LEU . . . -64.26 76.14 0.06 OUTLIER Glycine 0 CA--C 1.522 0.521 0 N-CA-C 114.425 0.53 . . . . 0.0 114.425 -173.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 168.54 -29.74 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.649 1.18 . . . . 0.0 107.974 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -126.2 14.4 7.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.946 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.525 ' HB3' HG13 ' A' ' 106' ' ' ILE . 7.4 t -70.12 135.18 48.93 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.635 -171.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.463 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 1.4 m -54.11 -33.4 57.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.03 -177.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.502 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 29.8 m-85 -68.67 -44.45 74.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.25 -175.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.525 HG13 ' HB3' ' A' ' 103' ' ' SER . 66.3 mt -53.25 -46.34 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.837 -173.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 11.2 m -67.84 -31.12 70.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.95 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.0 mt -70.28 -26.83 63.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 0.0 110.751 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.616 ' O ' ' HB3' ' A' ' 110' ' ' ASN . 84.0 m-85 -81.8 -2.68 51.71 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.121 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.616 ' HB3' ' O ' ' A' ' 109' ' ' TYR . 3.2 t30 80.77 -8.81 1.41 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.039 0.837 . . . . 0.0 109.788 -177.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.626 HG11 ' HG ' ' A' ' 114' ' ' LEU . 76.4 t -54.7 120.98 2.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.803 -1.089 . . . . 0.0 112.531 -171.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 6.3 m -89.32 -34.81 16.42 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.997 174.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -152.71 132.53 13.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.192 179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.743 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 88.6 mt -100.02 174.8 2.75 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.846 174.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.743 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.0 Cg_endo -70.84 156.47 95.71 Favored 'Cis proline' 0 C--N 1.362 1.249 0 CA-C-N 120.77 1.311 . . . . 0.0 114.028 1.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 69.1 m -156.88 146.38 20.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.83 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.497 HG12 ' HA3' ' A' ' 130' ' ' GLY . 3.3 p -103.91 156.93 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.622 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 77.0 m-85 -141.09 164.97 28.84 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.967 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 10.7 tp -111.73 138.53 48.18 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.531 -175.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.465 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 4.9 t -131.13 117.79 38.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.22 0.533 . . . . 0.0 110.005 171.297 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -69.15 161.39 29.21 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.635 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.543 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 25.3 mtm180 -53.94 -20.69 6.49 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -171.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.526 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 56.0 t30 -83.46 5.09 25.01 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.603 ' OD1' ' HA ' ' A' ' 31' ' ' THR . 1.4 m120 63.64 60.68 1.07 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.664 -167.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.532 ' HA ' HG21 ' A' ' 15' ' ' ILE . 56.3 mt-10 -126.2 118.15 24.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.352 179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.462 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.9 OUTLIER -57.58 109.04 0.63 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.392 0.615 . . . . 0.0 109.36 176.368 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.967 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -82.43 -48.59 10.92 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.486 -172.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -175.7 172.93 2.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.286 -178.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.575 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 78.7 mtt85 -90.89 156.65 17.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.074 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.497 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -59.33 -38.58 93.55 Favored Glycine 0 C--O 1.228 -0.221 0 C-N-CA 121.521 -0.371 . . . . 0.0 112.567 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.575 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.2 OUTLIER -79.46 -19.21 50.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.46 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.532 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -86.59 -19.58 29.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.511 0.672 . . . . 0.0 109.498 179.871 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.505 HD11 ' HB2' ' A' ' 119' ' ' LEU . 83.2 mt -92.28 123.27 44.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.562 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -57.12 -45.09 83.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.692 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.593 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 2.4 p-10 -156.61 128.66 7.36 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.565 ' O ' HG13 ' A' ' 140' ' ' ILE . 6.8 mp -75.31 -25.87 58.21 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.594 -174.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.518 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.0 t70 -50.74 -58.38 6.05 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 123.475 0.485 . . . . 0.0 109.931 174.143 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.593 ' HB2' ' OD2' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -55.96 -41.69 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.12 175.888 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.402 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -65.32 -52.61 52.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.82 -175.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.795 HD12 HD12 ' A' ' 60' ' ' LEU . 45.8 mt -59.96 -42.34 89.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.61 0.719 . . . . 0.0 109.878 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.9 ttpt -57.58 -40.03 78.1 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.331 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -84.67 -24.67 28.9 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.945 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 30.8 mt -66.45 -40.72 89.59 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-O 120.958 0.409 . . . . 0.0 110.164 175.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 64' ' ' TYR . 95.9 mt -60.72 -44.17 96.95 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.948 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -69.93 -65.62 0.7 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.078 176.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.18 -74.5 1.65 Allowed Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 -167.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 65.71 21.48 11.58 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.304 0.642 . . . . 0.0 111.856 168.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 149' ' ' HIS . 2.2 p-80 -167.37 72.36 0.11 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.253 0.549 . . . . 0.0 111.434 175.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' HIS . . . . . 0.403 ' HB2' ' O ' ' A' ' 148' ' ' HIS . 8.5 t-160 177.7 -35.75 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 46.1 m-70 -113.66 -164.64 0.94 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 167.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 34.8 t60 -74.56 -19.68 60.24 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 166.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 . . . . . 0 C--O 1.247 0.922 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.593 172.851 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.482 1.144 0 CA-C-O 120.821 0.343 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.8 p -94.83 155.85 16.62 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.172 177.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.2 tp -82.49 75.89 9.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.402 0.62 . . . . 0.0 109.738 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -90.61 85.02 5.98 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.159 -177.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 64.9 mt -117.77 101.09 52.35 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.486 175.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -76.35 -5.49 16.22 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.769 2.313 . . . . 0.0 112.717 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -81.3 88.15 6.09 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.175 -177.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -100.1 0.12 40.09 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.894 0.855 . . . . 0.0 110.524 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.943 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 26.4 ttpp -157.49 174.76 14.89 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.74 176.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.417 ' H ' ' CG ' ' A' ' 9' ' ' LYS . 17.5 pt -64.97 -3.8 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -167.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tppp? -168.88 25.79 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.344 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.943 ' HG2' ' HB3' ' A' ' 9' ' ' LYS . 22.0 mm-40 -107.59 105.14 14.88 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.262 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.45 100.79 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 O-C-N 124.164 0.915 . . . . 0.0 111.615 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.7 t -133.27 138.16 46.33 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -177.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 tp -129.98 121.36 51.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.335 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.458 175.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.765 ' H ' HD13 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -90.18 136.26 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.582 177.881 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -104.7 107.61 18.65 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.61 ' O ' ' HA ' ' A' ' 29' ' ' SER . 33.8 mt -92.47 110.53 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.252 -175.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -108.63 100.64 9.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.131 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.717 ' HB2' HG11 ' A' ' 95' ' ' VAL . 39.1 mt -139.33 166.4 24.64 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.685 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 34.2 mttm -96.5 150.26 20.82 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 121.129 0.49 . . . . 0.0 110.988 177.388 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.4 OUTLIER -82.55 -171.88 3.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.192 179.104 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 1.039 HD13 ' HA ' ' A' ' 88' ' ' ASP . 1.0 OUTLIER -49.28 -44.74 44.24 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.807 177.991 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -79.83 -20.41 46.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.011 -176.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.61 7.92 27.19 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.059 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -82.58 113.31 20.21 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.965 0.412 . . . . 0.0 110.377 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.685 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 24.9 m -69.76 119.86 14.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.542 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 14.8 mmm180 -110.27 138.67 46.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.773 177.049 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.61 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 12.0 p -119.39 164.27 15.97 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 174.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.548 HD22 HG11 ' A' ' 38' ' ' VAL . 33.5 mt -80.3 -34.03 37.14 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.415 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.5 p -65.05 -16.78 63.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.226 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -78.2 -37.49 45.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.865 0.841 . . . . 0.0 109.082 177.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.478 HD23 HG13 ' A' ' 38' ' ' VAL . 3.7 tp -81.44 5.65 16.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.487 -1.233 . . . . 0.0 111.427 -173.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -62.83 114.73 3.81 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.126 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.71 -39.74 1.0 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 -174.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.638 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 84.6 mttt -104.15 170.89 7.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 172.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.795 HG23 ' HD1' ' A' ' 69' ' ' PHE . 15.8 m -83.57 125.95 40.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 168.058 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.548 HG11 HD22 ' A' ' 30' ' ' LEU . 59.8 t -101.64 123.74 54.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.312 0.577 . . . . 0.0 111.664 -168.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 39' ' ' LEU . 12.4 tp -89.25 121.27 31.38 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.113 172.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.588 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -97.91 105.13 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.457 177.812 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.604 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 12.7 t70 -102.36 128.68 48.83 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.411 -177.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -121.77 97.7 5.61 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 176.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.803 ' O ' ' HA ' ' A' ' 75' ' ' SER . 31.1 m -138.66 147.41 42.81 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.758 -170.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.575 HG12 ' HG ' ' A' ' 76' ' ' LEU . 29.7 m -96.04 119.54 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 121.315 0.578 . . . . 0.0 109.998 173.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.528 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 5.5 m-85 -73.01 85.34 1.29 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.97 177.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 t30 173.94 -36.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.638 -172.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -74.04 150.87 40.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.613 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.89 -29.67 68.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -173.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.3 mtt -66.75 -20.48 65.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.601 0.239 . . . . 0.0 110.504 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.1 t -58.67 -29.17 66.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.109 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.63 -55.2 21.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.89 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.66 -30.86 64.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.53 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 82.5 t60 -69.49 -37.53 77.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -63.29 -38.62 91.88 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.282 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.13 -52.02 65.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.15 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.53 90.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.137 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 89.7 mt -62.9 -42.07 99.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.2 0.524 . . . . 0.0 109.912 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.84 -31.75 71.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.919 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.429 ' HG2' ' HE3' ' A' ' 63' ' ' LYS . 7.7 tt0 -75.94 -56.15 4.94 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 -172.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.833 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -54.69 -32.2 59.08 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.417 -2.174 . . . . 0.0 111.289 178.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -77.96 -50.62 11.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.139 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.412 HD22 ' N ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -65.14 -21.78 66.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.045 0.45 . . . . 0.0 110.865 -176.871 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HE3' ' HG2' ' A' ' 59' ' ' GLU . 89.8 mttt -77.3 -55.08 5.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.113 177.195 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.576 ' HB3' HD11 ' A' ' 144' ' ' LEU . 94.0 m-85 -113.79 -9.26 13.14 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -164.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.567 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -54.56 -43.34 71.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.403 ' HB2' ' OE1' ' A' ' 67' ' ' GLN . 12.2 m -67.77 -18.62 64.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.824 -175.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.437 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 0.9 OUTLIER -95.45 4.8 52.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.811 -179.108 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.59 51.57 0.7 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.637 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.795 ' HD1' HG23 ' A' ' 37' ' ' VAL . 56.6 t80 -127.85 143.07 51.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.615 0.245 . . . . 0.0 110.386 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.638 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.38 147.63 38.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.134 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.464 HD12 ' CE3' ' A' ' 92' ' ' TRP . 68.3 mt -112.96 117.77 56.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.156 0.503 . . . . 0.0 110.09 175.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.524 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 81.0 t80 -100.74 99.93 10.54 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 175.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.604 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 12.0 tm0? -91.12 143.37 26.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.828 -173.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.425 HD11 ' HE2' ' A' ' 72' ' ' TYR . 65.5 mt -136.86 121.61 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.803 ' HA ' ' O ' ' A' ' 43' ' ' THR . 89.3 p -99.99 121.13 40.88 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 121.524 0.678 . . . . 0.0 110.973 177.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.6 HD13 HD11 ' A' ' 106' ' ' ILE . 0.6 OUTLIER -101.56 43.29 1.07 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.123 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -77.48 -169.76 1.55 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.326 -1.306 . . . . 0.0 111.648 -174.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -129.18 21.39 5.2 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.603 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.413 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 28.0 t70 -162.64 115.14 1.63 Allowed 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.304 0.573 . . . . 0.0 110.236 -177.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.553 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 18.1 tt0 -77.35 -14.33 59.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.157 -176.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' HIS . . . . . 0.413 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 56.3 m80 -68.68 -56.85 6.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.793 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -60.61 -47.86 84.35 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 120.859 0.362 . . . . 0.0 110.067 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.528 ' CH2' ' HB2' ' A' ' 96' ' ' ARG . 39.5 t90 -55.51 -52.45 63.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.506 179.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.553 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 24.9 ttmt -65.8 -47.77 73.98 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.421 -174.15 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.8 p -62.98 -34.96 78.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.03 0.443 . . . . 0.0 111.317 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.1 m -78.43 -48.5 15.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.452 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.82 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -88.79 -21.05 23.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -168.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 1.039 ' HA ' HD13 ' A' ' 23' ' ' LEU . 28.2 t70 -57.93 -31.12 66.51 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -168.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -101.58 16.22 26.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.34 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.572 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 25.9 mt -81.25 157.65 70.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.09 0.472 . . . . 0.0 111.745 -178.551 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.628 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 56.1 Cg_endo -64.24 -52.15 1.72 Allowed 'Trans proline' 0 N--CA 1.477 0.536 0 C-N-CA 124.148 3.232 . . . . 0.0 113.575 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.628 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 13.1 p90 -89.55 179.02 6.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.227 0.537 . . . . 0.0 111.668 -173.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.542 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 48.4 t -76.48 123.68 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.102 -176.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.773 ' HB2' HD11 ' A' ' 23' ' ' LEU . 62.5 m -116.98 109.08 16.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.126 0.488 . . . . 0.0 110.131 -178.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.717 HG11 ' HB2' ' A' ' 20' ' ' LEU . 11.1 t -114.73 159.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.304 -172.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.528 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 31.3 ttt180 -122.02 142.15 50.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.737 0.303 . . . . 0.0 110.579 179.163 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -83.6 142.72 30.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.19 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.38 -5.58 58.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -172.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 91.7 m-20 -119.95 -13.73 9.0 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.051 -0.66 . . . . 0.0 112.568 -175.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 57.24 82.71 0.05 OUTLIER Glycine 0 CA--C 1.522 0.525 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.339 174.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.555 ' H ' ' HB2' ' A' ' 76' ' ' LEU . . . 74.35 -29.06 0.19 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.436 0.694 . . . . 0.0 111.556 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -85.38 21.57 1.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.537 ' HB3' HG13 ' A' ' 106' ' ' ILE . 38.3 t -61.56 144.51 54.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.811 -173.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.552 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 15.9 m -72.75 -29.89 63.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.741 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.413 ' HA ' HD12 ' A' ' 108' ' ' LEU . 88.2 m-85 -68.71 -40.7 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.445 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.6 HD11 HD13 ' A' ' 76' ' ' LEU . 74.2 mt -55.49 -34.3 34.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.834 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.5 m -80.44 -27.14 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.0 mt -68.55 -42.09 78.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.268 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.575 ' OH ' HG13 ' A' ' 16' ' ' ILE . 37.2 m-85 -80.58 -20.4 43.43 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.501 178.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 62.42 67.55 0.71 Allowed 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -169.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 40.6 t -78.39 132.48 32.29 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.824 -176.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 20.5 p -71.02 -47.33 59.28 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.025 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -172.44 129.57 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.241 0.543 . . . . 0.0 111.132 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.466 ' HG ' ' CD1' ' A' ' 76' ' ' LEU . 3.9 mm? -80.66 158.92 70.37 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.651 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.488 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 12.5 Cg_exo -73.42 156.02 99.65 Favored 'Cis proline' 0 C--N 1.349 0.57 0 C-N-CA 123.69 -1.379 . . . . 0.0 112.418 -0.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.5 m -140.26 170.08 16.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.286 -177.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.35 155.75 16.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.836 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.588 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 90.2 m-85 -138.1 157.73 45.75 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.697 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -111.46 141.85 44.49 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -177.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.532 HG23 HD11 ' A' ' 40' ' ' ILE . 6.8 t -138.7 129.4 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 174.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.639 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 4.6 p30 -85.45 170.61 12.51 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.063 178.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.531 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 13.4 ptt180 -52.72 -23.2 6.26 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -170.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -81.61 3.29 25.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.733 0.302 . . . . 0.0 110.24 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.411 HD22 ' HA ' ' A' ' 124' ' ' ASN . 2.1 t-20 65.93 53.28 1.13 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.598 -171.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.639 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 41.3 mt-10 -124.73 137.66 54.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.916 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 4.2 tt -68.18 109.31 3.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.318 0.58 . . . . 0.0 109.606 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.697 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 23.4 m -71.55 -57.84 4.04 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.237 -177.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.01 171.83 15.93 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.78 -175.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.584 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -98.75 146.06 26.29 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.783 -178.977 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -50.39 -26.69 10.09 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 121.528 -0.367 . . . . 0.0 113.041 178.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.77 -44.06 94.53 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.978 0.511 . . . . 0.0 111.592 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -104.51 -6.63 20.44 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -170.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.783 HG21 ' HG ' ' A' ' 136' ' ' LEU . 80.2 mt -76.57 100.44 2.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.193 0.52 . . . . 0.0 109.855 175.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.55 -50.07 75.0 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.044 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -139.59 109.07 6.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.978 -177.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.783 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.7 mp -70.46 -37.4 74.29 Favored 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.424 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.455 ' HA ' HD11 ' A' ' 60' ' ' LEU . 9.6 t70 -53.2 -52.33 59.21 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.591 177.051 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -64.16 -41.55 97.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.276 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.682 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -62.99 -50.73 69.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.853 -176.351 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.833 HD12 HD12 ' A' ' 60' ' ' LEU . 43.1 mt -61.15 -37.03 76.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.377 0.608 . . . . 0.0 110.272 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -61.94 -41.23 97.73 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.278 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.682 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -81.4 -19.51 42.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 111.193 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 75.4 mt -74.29 -39.54 62.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.809 176.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.576 HD11 ' HB3' ' A' ' 64' ' ' TYR . 65.4 mt -63.51 -41.79 98.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.423 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.643 ' HG3' ' H ' ' A' ' 146' ' ' GLY . 0.2 OUTLIER -72.11 -82.88 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.525 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.643 ' H ' ' HG3' ' A' ' 145' ' ' GLU . . . 58.83 34.68 78.98 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.255 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -175.81 137.97 0.36 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -133.0 101.61 5.3 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -159.15 17.85 0.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 0.0 110.44 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -170.53 -74.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.177 -176.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -165.6 149.21 8.06 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 52.2 p-80 . . . . . 0 C--O 1.245 0.856 0 CA-C-O 118.608 -0.71 . . . . 0.0 109.644 175.646 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.9 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 22.9 mmt . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.2 m -59.93 -49.0 79.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.775 -177.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 3' ' ' LEU . 3.9 mm? -100.9 25.21 8.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.107 0.48 . . . . 0.0 110.738 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.9 ' HB2' ' HB2' ' A' ' 1' ' ' MET . 20.5 tt0 -83.3 87.85 6.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.471 0.653 . . . . 0.0 109.378 178.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.4 mt -109.91 135.82 20.44 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.508 -174.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HB3' ' HA ' ' A' ' 13' ' ' ALA . 53.4 Cg_exo -57.6 -129.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.525 2.816 . . . . 0.0 113.087 171.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 61.16 30.53 19.39 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.773 0.797 . . . . 0.0 109.156 -176.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -85.43 -164.11 0.96 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.725 -173.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -144.07 25.92 1.54 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.181 179.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.0 mm -116.0 -20.54 5.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.684 0.754 . . . . 0.0 110.726 -177.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HB3' ' OG ' ' A' ' 14' ' ' SER . 57.1 tttm -160.76 -10.46 0.05 OUTLIER 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.588 -175.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 64.41 109.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.484 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.762 ' HB1' ' HG2' ' A' ' 125' ' ' GLU . . . 65.0 49.3 2.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.449 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.44 ' OG ' ' HB3' ' A' ' 11' ' ' LYS . 21.3 m -72.57 95.35 1.81 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.568 0.699 . . . . 0.0 111.316 -179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.847 HG21 ' H ' ' A' ' 126' ' ' LEU . 34.5 pt -99.17 -159.77 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.533 171.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.435 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.0 mp -86.41 89.71 2.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.86 115.43 9.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.694 174.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.502 HD11 ' OH ' ' A' ' 109' ' ' TYR . 7.0 mt -104.26 122.11 56.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.837 -177.322 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.636 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 2.2 mp0 -112.71 100.5 8.75 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.198 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.43 ' HG ' HG22 ' A' ' 18' ' ' ILE . 71.1 mt -132.81 156.19 47.58 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 97.1 mttt -82.3 138.02 34.67 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.886 0.374 . . . . 0.0 111.465 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -88.96 -167.66 1.95 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.87 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.593 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 55.4 tp -50.39 -36.86 34.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.77 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -77.74 -10.09 59.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.967 0.413 . . . . 0.0 111.805 -178.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.77 18.17 60.37 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -100.55 123.57 44.94 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.631 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 4.7 m -64.48 115.63 5.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.468 0.651 . . . . 0.0 111.367 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.636 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.6 mmm180 -88.06 142.67 27.59 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.851 172.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.63 ' CB ' ' HG3' ' A' ' 19' ' ' GLN . 1.5 m -124.01 138.56 54.44 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.253 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.543 HD22 HG11 ' A' ' 38' ' ' VAL . 50.5 mt -63.82 -32.92 74.59 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.026 178.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.8 0.05 14.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.258 177.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -105.27 -41.95 5.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.531 0.682 . . . . 0.0 109.339 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.47 ' CD1' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -78.83 -0.16 29.48 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.427 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.517 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 24.6 ttpp -63.09 102.87 0.41 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.714 176.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.86 -30.49 0.21 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -175.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.556 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -113.63 174.2 6.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 167.865 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.446 HG23 ' HD1' ' A' ' 69' ' ' PHE . 21.3 m -80.93 129.26 37.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.649 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 47.6 t -101.0 116.3 44.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.193 0.52 . . . . 0.0 110.812 -171.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.568 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 14.1 tp -82.84 111.75 19.03 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.622 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 27.4 mm -83.98 105.29 13.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.593 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 16.2 t70 -108.62 130.08 55.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.791 -178.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.585 ' HB3' HD21 ' A' ' 114' ' ' LEU . 51.5 m-85 -117.69 116.25 26.68 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 173.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.571 ' O ' ' HA ' ' A' ' 75' ' ' SER . 14.7 t -149.36 -176.44 5.38 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 -178.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.654 HG13 ' HB2' ' A' ' 47' ' ' ASN . 1.7 p -131.95 117.89 35.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 176.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.575 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 28.2 m-85 -77.42 79.33 3.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 122.173 0.987 . . . . 0.0 109.329 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.521 ' HB3' HG22 ' A' ' 44' ' ' VAL . 21.3 t-20 178.1 -27.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.208 -1.815 . . . . 0.0 109.297 -177.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.654 ' HB2' HG13 ' A' ' 44' ' ' VAL . 25.3 t-20 -86.16 141.09 29.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.72 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -25.8 66.6 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.163 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 94.5 mmm -68.43 -17.41 64.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.528 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.8 t -71.99 -28.48 63.44 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.64 -55.14 38.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.23 -26.39 63.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.245 0.545 . . . . 0.0 110.831 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.437 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 83.6 t60 -70.21 -45.52 66.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.524 -179.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.592 ' HA ' HD12 ' A' ' 57' ' ' LEU . 8.0 m120 -64.31 -28.05 69.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.986 178.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -62.8 -55.09 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.609 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.37 74.82 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.592 HD12 ' HA ' ' A' ' 54' ' ' ASN . 90.2 mt -63.56 -41.09 98.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.067 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -61.95 -30.32 70.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.092 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.32 -51.86 12.2 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -174.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 140' ' ' ILE . 2.4 mm? -58.05 -29.99 65.8 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 112.673 -2.058 . . . . 0.0 111.299 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -78.68 -50.35 11.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.028 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -60.6 -21.95 63.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.202 0.525 . . . . 0.0 110.613 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -79.56 -57.1 3.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.412 177.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.671 ' HB3' HD11 ' A' ' 144' ' ' LEU . 91.3 m-85 -112.64 -8.65 13.79 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -165.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.554 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -68.99 169.83 11.0 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.115 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.3 m 70.06 -35.04 0.3 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.744 0.652 . . . . 0.0 110.799 -174.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.519 ' H ' ' C ' ' A' ' 65' ' ' ALA . 23.1 mt-30 -82.25 16.88 1.83 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.716 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.96 18.04 14.86 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.994 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.568 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 66.8 t80 -107.61 144.49 34.57 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.556 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 8.7 tp10 -145.06 156.09 43.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.463 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' A' ' 92' ' ' TRP . 48.3 mt -120.26 129.49 75.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.062 0.458 . . . . 0.0 110.001 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.448 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 78.5 t80 -117.8 101.01 7.96 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.405 178.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.593 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 39.2 mt-30 -92.74 144.15 25.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.473 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.5 mt -123.66 116.4 48.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.329 172.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.575 ' HB3' ' HD1' ' A' ' 45' ' ' TYR . 62.7 p -92.11 134.51 34.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.377 . . . . 0.0 110.993 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.6 HD12 HD22 ' A' ' 114' ' ' LEU . 50.2 mt -104.65 37.35 2.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.311 0.577 . . . . 0.0 109.623 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.524 ' HA ' HG23 ' A' ' 44' ' ' VAL . 3.5 p30 -87.38 172.05 10.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.861 -173.257 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -125.85 34.36 3.3 Favored Glycine 0 N--CA 1.442 -0.925 0 N-CA-C 110.056 -1.217 . . . . 0.0 110.056 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -149.55 101.92 3.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.17 0.51 . . . . 0.0 109.906 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -76.57 -25.71 54.3 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.654 -174.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -74.34 -30.38 62.0 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.234 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -76.14 -47.62 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.865 174.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.593 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 59.3 t90 -56.37 -42.02 77.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.632 176.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.539 ' HA ' ' CD1' ' A' ' 23' ' ' LEU . 22.5 ttmm -67.14 -51.78 49.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.315 -179.121 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 m -69.36 -22.0 63.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 0.0 111.402 -175.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.482 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 22.8 t -85.08 -35.12 22.04 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.262 . . . . 0.0 110.682 178.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.542 ' HA ' HD12 ' A' ' 90' ' ' LEU . . . -79.5 -17.93 53.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.658 -176.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -50.15 -45.74 53.45 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.53 0.519 . . . . 0.0 112.116 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -100.07 14.86 29.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.331 -176.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.542 HD12 ' HA ' ' A' ' 87' ' ' ALA . 22.5 mt -88.09 144.73 34.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.38 0.609 . . . . 0.0 111.923 -176.403 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.692 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 59.7 Cg_endo -80.89 -38.9 0.24 Allowed 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.828 3.019 . . . . 0.0 113.687 -176.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.692 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.2 p90 -101.17 -169.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.166 -171.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.51 HG11 ' HG3' ' A' ' 28' ' ' ARG . 46.7 t -91.93 131.42 39.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.791 0.329 . . . . 0.0 110.689 -172.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 85.4 m -130.31 114.91 16.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.284 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.605 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.4 m -115.97 165.74 10.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -121.92 144.51 48.82 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.349 -179.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -89.17 157.21 18.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.35 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.1 -33.39 29.77 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -174.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.59 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 53.7 t30 -118.13 -12.21 10.05 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.499 -171.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.9 -128.26 8.5 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.657 175.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.5 4.01 5.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.59 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 20.7 m-85 -111.69 13.02 21.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.97 0.414 . . . . 0.0 109.949 178.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.2 t -64.74 137.43 57.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.443 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 14.8 m -64.36 -24.24 67.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.018 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -61.08 -46.13 91.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.958 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.535 HG22 ' CG1' ' A' ' 111' ' ' VAL . 20.9 mt -61.54 -31.23 50.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.075 -174.155 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 14.3 m -71.18 -23.05 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.349 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.33 -17.27 46.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.502 ' OH ' HD11 ' A' ' 18' ' ' ILE . 90.4 m-85 -89.49 -20.59 23.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.198 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 32.3 t30 56.47 72.47 0.5 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 122.204 1.002 . . . . 0.0 108.708 -167.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.535 ' CG1' HG22 ' A' ' 106' ' ' ILE . 7.5 p -75.77 136.11 25.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.921 -178.519 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 4.6 m -78.65 -50.54 11.3 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.315 0.579 . . . . 0.0 109.572 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -168.59 139.06 2.49 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.36 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.6 HD22 HD12 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -99.9 154.49 37.21 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 27.4 Cg_endo -62.94 153.28 69.31 Favored 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.296 -1.127 . . . . 0.0 113.621 0.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.4 m -137.33 170.67 15.69 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.271 -177.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.5 p -142.44 153.69 18.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.622 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 64.1 m-85 -140.85 164.8 29.25 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 1.016 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 9.9 tp -110.7 134.5 52.4 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.649 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 10.3 t -125.93 117.25 48.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.421 0.629 . . . . 0.0 110.532 171.011 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.488 ' HA ' HD13 ' A' ' 143' ' ' LEU . 18.4 t30 -68.9 161.76 28.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.283 177.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -17.66 10.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -169.554 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -90.95 14.79 12.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.005 0.431 . . . . 0.0 110.17 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.517 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 1.0 OUTLIER 59.0 58.96 2.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.025 -175.182 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.762 ' HG2' ' HB1' ' A' ' 13' ' ' ALA . 32.5 mt-10 -124.22 123.77 40.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.054 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.847 ' H ' HG21 ' A' ' 15' ' ' ILE . 19.6 mt -56.52 107.21 0.36 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.417 0.627 . . . . 0.0 110.016 172.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' SER . . . . . 1.016 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 49.5 m -79.7 -42.47 24.6 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.681 -175.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 179.96 172.74 1.01 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.392 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.505 ' O ' HG13 ' A' ' 133' ' ' ILE . 86.7 mtm180 -103.59 159.25 15.76 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.909 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -47.23 -43.83 19.43 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 114.327 0.491 . . . . 0.0 114.327 -174.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -72.55 -29.68 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.095 0.474 . . . . 0.0 111.379 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.413 ' OD1' ' HB2' ' A' ' 129' ' ' ARG . 8.9 m120 -79.54 -26.44 41.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.829 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.862 HG21 ' HG ' ' A' ' 136' ' ' LEU . 78.3 mt -82.01 112.3 19.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.877 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.449 ' N ' ' HD2' ' A' ' 134' ' ' LYS . 3.3 mptp? -90.44 98.11 11.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.984 174.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.93 106.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.131 -176.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.862 ' HG ' HG21 ' A' ' 133' ' ' ILE . 6.0 mp -70.07 -25.37 63.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.518 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -50.59 -52.64 37.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.375 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.52 -44.14 95.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.046 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.472 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -57.83 -53.88 53.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.698 -176.046 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.843 HD12 HD12 ' A' ' 60' ' ' LEU . 42.4 mt -60.37 -39.96 82.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.007 0.432 . . . . 0.0 111.115 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 3.9 ttmp? -58.5 -44.36 89.39 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.744 -178.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -78.94 -24.45 43.96 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.769 -176.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 121' ' ' ASN . 27.5 mt -72.18 -38.14 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.24 0.543 . . . . 0.0 110.372 175.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.671 HD11 ' HB3' ' A' ' 64' ' ' TYR . 28.6 mt -61.48 -42.09 98.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.001 -178.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -71.15 -37.05 72.25 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.174 -175.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.431 ' O ' ' HB2' ' A' ' 147' ' ' HIS . . . 53.21 51.51 46.43 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 121.288 -0.482 . . . . 0.0 113.36 174.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 146' ' ' GLY . 71.9 m-70 73.69 -60.82 0.52 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 177.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' HIS . . . . . 0.503 ' O ' ' HB2' ' A' ' 149' ' ' HIS . 79.8 t60 -90.27 -28.36 18.85 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -167.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' HIS . . . . . 0.503 ' HB2' ' O ' ' A' ' 148' ' ' HIS . 55.9 m-70 71.33 145.55 0.07 Allowed 'General case' 0 N--CA 1.471 0.589 0 O-C-N 123.409 0.443 . . . . 0.0 110.821 -171.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -177.56 -66.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.893 178.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -83.78 -5.01 59.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.358 0.599 . . . . 0.0 109.441 175.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 . . . . . 0 C--O 1.246 0.901 0 CA-C-N 114.706 -1.134 . . . . 0.0 107.976 176.938 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mpp? . . . . . 0 N--CA 1.484 1.241 0 CA-C-O 120.767 0.318 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.2 m -92.92 98.15 11.18 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 176.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 45.1 tp -121.38 118.3 29.09 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.091 -175.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.38 -3.36 40.43 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.547 0.689 . . . . 0.0 110.981 -176.131 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.5 tt -127.15 122.13 22.96 Favored Pre-proline 0 C--N 1.315 -0.926 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.526 -177.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.519 ' HG2' ' H ' ' A' ' 13' ' ' ALA . 36.7 Cg_endo -64.06 171.69 7.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.038 2.492 . . . . 0.0 113.622 -175.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -117.26 -178.56 3.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.468 -176.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.41 ' OD2' ' HG3' ' A' ' 9' ' ' LYS . 4.9 p-10 -76.81 164.07 26.19 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 171.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.41 ' HG3' ' OD2' ' A' ' 8' ' ' ASP . 54.5 mttp 71.6 8.34 6.17 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.894 0.855 . . . . 0.0 109.453 -172.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.578 HG22 ' H ' ' A' ' 11' ' ' LYS . 2.5 mt -137.21 178.93 4.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 114.323 -1.308 . . . . 0.0 107.5 176.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.578 ' H ' HG22 ' A' ' 10' ' ' ILE . 4.2 mptp? -83.45 92.54 7.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.52 0.676 . . . . 0.0 109.492 176.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -80.12 139.82 36.69 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.531 -174.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.519 ' H ' ' HG2' ' A' ' 6' ' ' PRO . . . 61.83 25.57 15.39 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.436 173.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.4 p -83.77 -27.5 28.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.209 0.528 . . . . 0.0 109.988 175.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.699 HG21 ' O ' ' A' ' 124' ' ' ASN . 6.9 tt -171.07 147.49 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.254 179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.502 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.9 mp -97.26 138.01 23.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -92.64 108.48 20.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.558 HD11 ' OH ' ' A' ' 109' ' ' TYR . 8.9 mt -89.47 115.4 29.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.352 -177.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -111.91 100.16 8.68 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.517 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.704 ' HB2' HG11 ' A' ' 95' ' ' VAL . 22.2 mt -136.08 162.42 32.96 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.636 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.1 mttm -90.83 147.47 23.16 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.67 0.747 . . . . 0.0 111.17 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.59 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.7 OUTLIER -84.27 -173.51 4.76 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.625 -174.036 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.86 HD11 ' HA ' ' A' ' 84' ' ' LYS . 15.0 tp -54.29 -42.73 70.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.616 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.509 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.02 -39.92 83.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.601 178.314 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.471 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 124.12 13.91 3.87 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.172 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -96.7 125.44 41.16 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 122.818 -0.225 . . . . 0.0 110.536 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.636 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 7.8 m -63.33 113.6 3.32 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.407 0.622 . . . . 0.0 110.586 177.276 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.514 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 9.4 mmm180 -102.16 127.97 48.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.246 177.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 57.6 p -115.67 158.42 22.77 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 174.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.529 HD22 HG11 ' A' ' 38' ' ' VAL . 79.0 mt -74.07 -29.12 61.72 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.4 p -63.37 -22.6 66.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.569 175.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -91.13 -34.42 15.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.602 0.715 . . . . 0.0 109.724 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.681 HD11 ' HG2' ' A' ' 70' ' ' GLU . 11.9 tp -82.01 10.04 7.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.857 -177.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -64.18 -11.17 28.25 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.591 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.36 -18.46 65.38 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.1 -178.31 4.77 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.891 0.377 . . . . 0.0 110.266 177.271 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.674 HG23 ' HD1' ' A' ' 69' ' ' PHE . 16.6 m -85.36 126.83 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 168.421 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.529 HG11 HD22 ' A' ' 30' ' ' LEU . 38.7 t -101.04 129.18 52.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.27 0.557 . . . . 0.0 111.663 -167.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.761 HD11 HD21 ' A' ' 136' ' ' LEU . 12.4 tp -95.72 110.58 22.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.512 173.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.557 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.0 mm -84.77 105.78 14.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -114.04 129.82 56.59 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.898 -175.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -116.58 97.78 6.19 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.76 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 m -137.95 141.45 40.54 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.212 0.53 . . . . 0.0 111.518 -170.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.66 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.1 OUTLIER -95.63 118.22 41.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.018 -177.799 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.793 ' HE1' HE21 ' A' ' 73' ' ' GLN . 25.2 m-85 -77.26 80.74 3.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.662 0.744 . . . . 0.0 109.708 174.389 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.479 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 19.7 t-20 174.35 -33.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.855 -176.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.66 ' HB2' HG13 ' A' ' 44' ' ' VAL . 8.0 t-20 -73.4 148.85 42.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.031 -176.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.43 -33.54 71.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.807 -178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.1 tpp -67.58 -26.79 66.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.061 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.7 m -60.99 -32.97 72.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.997 -175.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.69 95.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.842 0.353 . . . . 0.0 111.191 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.66 -29.49 45.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.098 0.475 . . . . 0.0 110.572 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.445 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 85.5 t60 -65.85 -42.41 90.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.819 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.401 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.5 m-20 -66.23 -21.44 66.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.591 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.2 tm? -64.14 -54.92 26.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.416 0.627 . . . . 0.0 109.91 176.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.18 -33.11 72.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.8 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 86.8 mt -65.15 -40.45 94.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.804 176.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.451 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.1 tpt180 -59.28 -33.51 71.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.778 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.81 -55.1 6.18 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -172.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.81 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.2 -31.91 61.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 112.846 -1.979 . . . . 0.0 111.624 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.404 ' HD1' HG13 ' A' ' 71' ' ' ILE . 24.9 t80 -77.97 -48.8 15.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.978 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.406 ' N ' HD22 ' A' ' 62' ' ' ASN . 1.0 OUTLIER -63.79 -21.68 66.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.548 -177.588 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -77.36 -58.62 3.17 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.91 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.623 ' CE1' ' HG3' ' A' ' 141' ' ' LYS . 96.2 m-85 -109.14 -10.65 14.98 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -165.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -53.65 -37.87 63.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.219 0.463 . . . . 0.0 111.849 -176.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.4 m -67.64 -15.21 63.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -107.99 9.61 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 0.0 111.054 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.439 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 104.88 48.97 1.04 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.912 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.674 ' HD1' HG23 ' A' ' 37' ' ' VAL . 72.4 t80 -121.92 138.77 54.28 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.681 ' HG2' HD11 ' A' ' 33' ' ' LEU . 8.7 tp10 -138.69 146.03 41.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.287 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.422 HD12 ' CE3' ' A' ' 92' ' ' TRP . 72.2 mt -112.41 124.64 69.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.927 0.394 . . . . 0.0 110.239 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.595 ' CE1' HG21 ' A' ' 95' ' ' VAL . 89.9 t80 -104.5 100.0 9.68 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.793 HE21 ' HE1' ' A' ' 45' ' ' TYR . 7.0 tp60 -83.49 136.67 34.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.861 -177.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -125.78 108.32 19.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.76 ' HA ' ' O ' ' A' ' 43' ' ' THR . 66.5 p -83.11 126.3 32.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.309 0.576 . . . . 0.0 111.189 -175.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.519 HD22 ' H ' ' A' ' 101' ' ' ALA . 17.3 mt -102.94 39.36 1.56 Allowed 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.594 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.8 p-10 -61.42 -71.91 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.266 -170.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.41 12.25 42.3 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -170.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -163.1 100.47 0.97 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.9 -26.37 61.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.008 -171.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -74.02 -29.1 61.76 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.694 -0.803 . . . . 0.0 110.89 -174.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -71.68 -48.9 44.38 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.579 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 27.9 t90 -60.67 -47.19 87.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.293 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.86 ' HA ' HD11 ' A' ' 23' ' ' LEU . 12.2 ttmt -62.35 -45.33 93.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.639 0.257 . . . . 0.0 111.497 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -68.12 -31.23 70.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.461 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.4 p -85.58 -33.67 21.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.897 0.38 . . . . 0.0 111.651 -177.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.522 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -86.32 -18.92 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.604 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 15.1 t70 -64.12 -27.05 68.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.899 0.381 . . . . 0.0 111.789 -173.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -97.0 8.23 44.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.282 0.563 . . . . 0.0 110.419 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.3 mt -86.89 152.21 53.32 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.179 0.514 . . . . 0.0 111.726 -177.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.594 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -72.53 -58.67 0.07 OUTLIER 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.691 2.928 . . . . 0.0 114.046 -176.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.594 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.9 p90 -83.35 -173.79 4.91 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.064 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.98 124.63 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 m -117.94 109.47 16.54 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.704 HG11 ' HB2' ' A' ' 20' ' ' LEU . 11.3 t -115.99 156.56 17.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.814 -176.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.427 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 14.8 ttp180 -113.21 139.62 48.63 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.487 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.67 156.99 20.44 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.955 0.407 . . . . 0.0 110.065 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.04 -29.17 32.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -175.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -114.26 -14.1 12.3 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -171.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.405 ' O ' ' HB3' ' A' ' 101' ' ' ALA . . . 67.56 78.03 0.3 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.486 178.259 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.519 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 80.42 -31.53 0.12 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.878 0.871 . . . . 0.0 111.897 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -85.01 37.34 0.66 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.344 0.593 . . . . 0.0 110.016 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.547 ' HB3' HG13 ' A' ' 106' ' ' ILE . 22.8 t -89.7 141.95 28.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.126 -172.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.438 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 2.9 p -61.28 -38.22 85.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.178 178.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -55.35 -44.48 75.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.377 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.547 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.5 mt -64.27 -28.94 46.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.011 -176.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 27.9 m -77.8 -24.76 48.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.582 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.9 mt -71.18 -37.23 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.993 -179.065 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.558 ' OH ' HD11 ' A' ' 18' ' ' ILE . 93.3 m-85 -69.87 -23.14 63.22 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.292 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 38.2 t30 59.49 69.01 0.74 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.384 1.088 . . . . 0.0 108.801 -167.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.584 HG11 HD21 ' A' ' 114' ' ' LEU . 13.1 p -79.16 153.24 4.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 113.855 -1.52 . . . . 0.0 111.045 -177.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.445 ' HB ' ' HG2' ' A' ' 131' ' ' GLU . 1.7 m -102.94 -31.16 10.37 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.428 177.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -157.18 124.17 5.13 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -175.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.642 HD13 ' OG ' ' A' ' 116' ' ' SER . 3.0 mm? -98.75 143.47 26.41 Favored Pre-proline 0 N--CA 1.469 0.486 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 170.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.429 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 24.1 Cg_exo -65.26 152.52 77.46 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 124.474 -1.052 . . . . 0.0 112.655 0.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.642 ' OG ' HD13 ' A' ' 114' ' ' LEU . 13.0 m -127.55 166.12 18.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.036 -175.05 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 40' ' ' ILE . 7.9 p -143.28 154.56 16.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.557 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 84.4 m-85 -139.02 163.74 31.6 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 176.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.897 HD13 HD11 ' A' ' 136' ' ' LEU . 14.7 tp -110.53 135.43 51.2 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 44.9 t -133.62 125.08 49.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.754 0.312 . . . . 0.0 110.484 176.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.577 ' HB3' HD22 ' A' ' 143' ' ' LEU . 8.9 p30 -82.9 166.75 18.65 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -75.31 18.62 0.2 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -169.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.467 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 63.4 t30 -95.22 -0.86 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 166.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.699 ' O ' HG21 ' A' ' 15' ' ' ILE . 48.3 t30 59.78 67.21 0.9 Allowed 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.561 -165.473 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.1 mm-40 -137.83 141.76 40.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.326 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 47.8 mt -68.88 130.79 43.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.536 0.684 . . . . 0.0 110.729 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.84 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 73.2 m -101.63 -49.87 3.88 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.942 -177.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -164.86 164.5 20.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.859 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.418 ' O ' HG13 ' A' ' 133' ' ' ILE . 92.8 mtt180 -96.96 162.24 13.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.21 -36.37 92.3 Favored Glycine 0 C--O 1.226 -0.374 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.242 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.445 ' HG2' ' HB ' ' A' ' 112' ' ' THR . 2.7 mp0 -76.46 -1.87 29.28 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 0.0 110.736 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -112.49 -18.13 12.49 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 110.539 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.703 HD13 HD13 ' A' ' 136' ' ' LEU . 96.7 mt -88.82 110.13 20.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.3 0.572 . . . . 0.0 111.247 -175.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.656 ' HG3' ' H ' ' A' ' 135' ' ' ASP . 11.2 ptmm? -72.94 -60.07 2.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 174.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.656 ' H ' ' HG3' ' A' ' 134' ' ' LYS . 7.2 m-20 -128.06 116.67 20.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.897 HD11 HD13 ' A' ' 119' ' ' LEU . 2.9 tp -75.28 -27.25 59.31 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.293 0.568 . . . . 0.0 109.553 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -52.55 -56.29 16.28 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.608 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.416 ' HG2' ' HB2' ' A' ' 135' ' ' ASP . 12.1 pt-20 -62.46 -48.65 78.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.033 0.444 . . . . 0.0 111.33 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 138' ' ' GLU . . . -55.95 -54.25 46.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.286 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.81 HD12 HD12 ' A' ' 60' ' ' LEU . 27.0 mt -63.5 -29.68 47.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.727 0.299 . . . . 0.0 111.247 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.623 ' HG3' ' CE1' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -61.8 -43.81 98.11 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 110.018 177.508 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 59.5 mmtt -75.27 -19.2 59.84 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.014 -178.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.577 HD22 ' HB3' ' A' ' 121' ' ' ASN . 40.2 mt -71.82 -40.25 69.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.289 0.566 . . . . 0.0 110.506 175.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.495 HD11 ' HB3' ' A' ' 64' ' ' TYR . 95.4 mt -71.77 -43.29 65.99 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.56 -177.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 146' ' ' GLY . 12.4 pt-20 -80.98 -50.77 9.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.769 178.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.417 ' N ' ' HG3' ' A' ' 145' ' ' GLU . . . 62.89 -133.68 43.65 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.446 -0.407 . . . . 0.0 112.387 -178.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -159.67 64.83 0.37 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.796 0.807 . . . . 0.0 109.928 174.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -145.25 21.7 1.54 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.548 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 150' ' ' HIS . 69.9 m80 -118.0 11.89 13.52 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.869 178.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.428 ' HB2' ' O ' ' A' ' 149' ' ' HIS . 37.6 m80 72.9 -60.83 0.52 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.039 -178.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -79.85 -23.78 41.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.308 0.575 . . . . 0.0 109.525 173.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 . . . . . 0 C--O 1.245 0.816 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 169.766 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.6 ttt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.96 0.409 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 p -83.11 -65.01 1.06 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.845 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.6 tp -116.14 114.16 24.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.82 -178.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -99.93 134.18 43.22 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.048 177.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 44.8 mm -124.28 90.06 51.24 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 120.734 0.302 . . . . 0.0 111.2 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -82.45 164.14 16.75 Favored 'Trans proline' 0 CA--C 1.512 -0.577 0 C-N-CA 122.584 2.19 . . . . 0.0 112.138 171.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -163.27 149.98 12.39 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.077 -168.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -163.04 94.46 0.83 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.044 -179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.544 ' HG2' HG13 ' A' ' 10' ' ' ILE . 4.7 ttpm? 67.36 -79.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.982 0.801 . . . . 0.0 112.848 169.028 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.544 HG13 ' HG2' ' A' ' 9' ' ' LYS . 9.7 mt -111.72 46.24 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.44 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.421 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 12.6 ttpp 57.83 36.14 26.1 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.773 0.797 . . . . 0.0 109.947 179.564 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -84.2 -27.77 27.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.664 -171.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.19 -7.47 42.14 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.206 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.2 m -67.58 101.63 1.04 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.489 0.661 . . . . 0.0 109.935 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.576 HG21 ' O ' ' A' ' 124' ' ' ASN . 13.5 tt -65.85 143.25 15.85 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.762 -177.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.453 HG12 HD13 ' A' ' 108' ' ' LEU . 4.4 mp -99.31 130.65 47.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.486 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -75.85 107.51 8.08 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.505 HD11 ' OH ' ' A' ' 109' ' ' TYR . 9.2 mt -89.02 105.37 15.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.686 -172.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.674 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 76.8 mt-30 -100.12 99.95 10.73 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.522 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.8 mt -136.82 153.11 50.89 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 176.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.68 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 90.8 mttt -87.87 136.23 33.05 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.907 0.86 . . . . 0.0 112.103 -173.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.08 165.85 3.99 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.5 -1.682 . . . . 0.0 108.952 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.531 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER -59.43 -30.05 68.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.642 0.734 . . . . 0.0 110.143 179.083 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.521 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 36.3 mtmm -69.05 -8.54 46.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.13 176.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.39 8.06 61.49 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.406 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -97.23 111.98 23.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.7 0.286 . . . . 0.0 111.538 -176.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.68 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 52.7 m -57.93 118.47 5.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.329 0.585 . . . . 0.0 111.225 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.674 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 24.3 mmt180 -93.51 143.87 25.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.648 176.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.1 p -122.79 150.82 42.3 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 170.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.459 ' HG ' ' H ' ' A' ' 18' ' ' ILE . 31.4 mt -71.03 -29.9 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.051 0.453 . . . . 0.0 109.974 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 p -61.86 -19.42 62.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.425 175.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.25 -38.34 16.41 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.724 0.773 . . . . 0.0 109.848 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.643 HD23 HG13 ' A' ' 38' ' ' VAL . 11.5 tp -78.55 -1.51 34.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.884 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.561 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 36.1 ttpt -64.77 -10.59 28.83 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.476 0.655 . . . . 0.0 111.068 179.284 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.11 -15.27 60.45 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.917 -0.658 . . . . 0.0 111.734 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -132.2 -179.23 5.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.416 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.495 HG22 ' HB3' ' A' ' 122' ' ' ARG . 99.7 t -84.8 128.9 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 170.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.643 HG13 HD23 ' A' ' 33' ' ' LEU . 43.6 t -106.57 122.77 60.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.292 0.568 . . . . 0.0 112.396 -162.466 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.671 HD11 HD21 ' A' ' 136' ' ' LEU . 13.3 tp -95.08 116.94 29.36 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.93 172.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.627 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 20.7 mm -91.4 106.34 17.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 178.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.551 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.0 t70 -107.53 141.38 39.06 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.73 0.3 . . . . 0.0 111.101 -178.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -128.46 111.84 13.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.699 174.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 t -154.84 175.09 14.18 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.937 0.399 . . . . 0.0 111.006 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.661 HG23 ' HB2' ' A' ' 47' ' ' ASN . 7.9 m -112.98 121.68 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.923 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -75.99 83.83 2.88 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 173.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 179.98 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.684 -167.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.661 ' HB2' HG23 ' A' ' 44' ' ' VAL . 2.1 t-20 -88.5 149.61 23.54 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.387 -168.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.01 -29.97 69.1 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.67 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.7 -25.55 64.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.555 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 m -67.85 -27.49 66.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.14 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.22 -54.59 38.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.63 -38.03 86.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.171 0.51 . . . . 0.0 110.568 178.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.43 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.4 t60 -61.6 -40.91 96.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.711 179.018 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.587 ' HA ' HD12 ' A' ' 57' ' ' LEU . 4.1 t30 -71.33 -34.72 70.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.749 -178.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.58 -41.76 92.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.29 80.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.328 0.585 . . . . 0.0 110.205 176.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 ' HA ' ' A' ' 54' ' ' ASN . 58.8 mt -67.34 -39.67 85.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.663 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.47 ' HD2' ' OD1' ' A' ' 62' ' ' ASN . 3.3 tpp180 -61.31 -24.96 66.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.289 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -74.46 -56.11 5.22 Favored 'General case' 0 CA--C 1.488 -1.436 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.604 HD11 ' HA ' ' A' ' 137' ' ' ASP . 2.1 mm? -56.19 -29.14 60.49 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-N 111.749 -2.478 . . . . 0.0 111.11 177.146 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.409 ' CE2' ' HB2' ' A' ' 91' ' ' PRO . 37.6 t80 -76.38 -52.95 8.87 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.439 -178.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.47 ' OD1' ' HD2' ' A' ' 58' ' ' ARG . 5.9 m-20 -62.48 -22.38 66.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.171 0.51 . . . . 0.0 110.369 -178.341 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -81.19 -62.05 1.77 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.832 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.614 ' HB3' ' CD1' ' A' ' 144' ' ' LEU . 87.9 m-85 -107.76 -8.08 16.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -163.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.524 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.48 -16.89 64.46 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.706 -0.621 . . . . 0.0 111.428 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.8 m -85.56 5.6 30.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.525 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -118.41 14.83 13.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.214 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.17 43.01 3.88 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.832 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.524 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 83.3 t80 -127.91 138.81 52.79 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -177.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -145.24 141.59 28.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 0.0 109.847 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.476 HD12 ' CE3' ' A' ' 92' ' ' TRP . 56.3 mt -99.06 132.79 43.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.941 -174.144 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.515 ' HB2' ' CD2' ' A' ' 33' ' ' LEU . 90.1 t80 -111.02 101.43 9.99 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.067 177.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 40.1 tt0 -102.72 119.11 38.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.15 0.5 . . . . 0.0 111.399 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.466 HD11 HG21 ' A' ' 18' ' ' ILE . 69.9 mt -96.69 127.93 48.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.777 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.0 m -100.37 129.63 46.37 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.401 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.513 HD13 HD12 ' A' ' 114' ' ' LEU . 0.7 OUTLIER -123.86 22.28 8.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.075 0.464 . . . . 0.0 110.461 177.569 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.536 ' HB3' ' HB ' ' A' ' 44' ' ' VAL . 4.6 p-10 -79.09 178.68 7.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.085 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.09 30.84 5.7 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.608 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -135.64 102.49 5.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.639 . . . . 0.0 111.028 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 28.5 tt0 -69.81 -18.33 63.46 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.876 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -70.09 -59.5 2.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.931 -176.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -66.32 -36.06 81.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.502 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.531 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 33.2 t90 -57.56 -60.05 4.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.866 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.451 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 31.6 ttmt -61.17 -44.19 97.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.144 -174.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.3 m -62.41 -49.13 76.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.439 -178.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.636 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.1 t -70.82 -45.94 63.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.618 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.457 ' HB1' HD22 ' A' ' 23' ' ' LEU . . . -58.85 -40.58 84.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -175.298 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.33 -28.84 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.294 0.569 . . . . 0.0 110.611 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -96.99 7.26 47.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.306 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 86' ' ' SER . 32.3 mt -100.01 153.59 37.68 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-O 121.177 0.513 . . . . 0.0 111.837 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.637 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.6 Cg_endo -75.17 -45.32 0.28 Allowed 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 123.958 3.106 . . . . 0.0 114.005 -176.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.637 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.0 p90 -94.96 -171.04 2.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.443 . . . . 0.0 112.021 -171.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.2 t -80.05 124.83 38.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.668 -174.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 39.1 m -123.44 109.4 13.8 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.379 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 18.6 m -122.31 161.51 23.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.885 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.423 HH12 ' HB2' ' A' ' 80' ' ' GLU . 59.4 ttp180 -124.47 144.21 50.21 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.054 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.97 163.44 24.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.125 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.0 -32.82 30.39 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -177.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.564 ' HB3' ' HB2' ' A' ' 102' ' ' TYR . 64.9 m-20 -113.75 -12.41 12.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.691 0.281 . . . . 0.0 111.488 -172.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.83 -116.3 5.58 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.207 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.29 -14.34 62.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.064 0.459 . . . . 0.0 111.118 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.564 ' HB2' ' HB3' ' A' ' 99' ' ' ASN . 97.8 m-85 -96.5 19.64 11.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.369 177.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.459 ' HB3' HG13 ' A' ' 106' ' ' ILE . 45.4 t -66.79 138.99 57.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.016 -178.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.583 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.9 m -67.61 -25.84 65.95 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.281 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.52 ' HA ' HD12 ' A' ' 108' ' ' LEU . 98.0 m-85 -61.7 -42.3 98.76 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.203 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.459 HG13 ' HB3' ' A' ' 103' ' ' SER . 67.5 mt -59.94 -32.72 50.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.841 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.2 m -76.81 -33.3 57.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.852 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -62.92 -39.5 94.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.735 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.505 ' OH ' HD11 ' A' ' 18' ' ' ILE . 68.3 m-85 -81.57 -19.42 42.04 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.438 178.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 t30 63.54 75.32 0.39 Allowed 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -166.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.454 ' HB ' HG23 ' A' ' 106' ' ' ILE . 25.1 t -98.85 132.89 43.26 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.31 -177.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 3.7 m -74.93 -44.51 48.23 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.344 179.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -170.57 133.1 0.99 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.726 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.705 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 80.0 mt -85.63 170.15 13.85 Favored Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 171.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.705 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.96 153.94 96.23 Favored 'Cis proline' 0 C--N 1.355 0.891 0 CA-C-N 120.005 1.037 . . . . 0.0 113.202 0.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 69.1 m -145.13 172.91 12.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.481 -177.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.574 HG12 ' HA3' ' A' ' 130' ' ' GLY . 2.7 p -142.31 158.75 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.035 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.627 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 95.3 m-85 -140.96 161.95 36.63 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 176.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.804 HD13 HD11 ' A' ' 136' ' ' LEU . 17.0 tp -111.05 134.56 52.55 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.175 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.579 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 16.8 t -131.1 119.07 43.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.886 0.374 . . . . 0.0 110.182 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.598 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 3.5 p30 -74.69 164.44 26.58 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.495 ' HB3' HG22 ' A' ' 37' ' ' VAL . 18.0 ptt180 -52.56 -19.19 2.12 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 124.429 1.081 . . . . 0.0 113.795 -171.494 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -84.3 11.49 8.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.068 0.461 . . . . 0.0 109.907 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.576 ' O ' HG21 ' A' ' 15' ' ' ILE . 36.3 t30 57.79 55.35 5.5 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.161 -176.133 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.598 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 31.7 mt-10 -129.06 146.74 50.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.554 178.452 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.3 mt -72.61 112.09 8.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.171 0.51 . . . . 0.0 111.029 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.641 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 9.9 m -74.3 -56.87 4.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.527 177.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.94 170.93 11.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.909 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.567 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 14.7 mmt180 -82.89 152.67 25.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.574 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -62.28 -34.04 87.97 Favored Glycine 0 CA--C 1.509 -0.337 0 N-CA-C 111.712 -0.555 . . . . 0.0 111.712 177.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 131' ' ' GLU . 17.8 mp0 -64.35 -28.68 69.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.682 -0.759 . . . . 0.0 110.21 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -99.47 -6.32 27.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.752 -171.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 129' ' ' ARG . 85.0 mt -102.76 108.52 24.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.182 -179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.409 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 18.5 pttp -64.17 -48.56 75.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.942 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.409 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 7.3 m-20 -127.77 107.38 9.84 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.804 HD11 HD13 ' A' ' 119' ' ' LEU . 7.3 tp -74.92 -34.6 62.14 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -178.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.604 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.5 t70 -46.93 -58.2 4.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.682 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -62.72 -45.37 93.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.562 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.515 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.7 -52.24 64.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.695 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.661 HG13 ' O ' ' A' ' 136' ' ' LEU . 52.5 mt -57.82 -45.83 87.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 0.0 110.395 177.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 66.7 tttm -52.69 -46.52 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.934 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.705 ' HA ' ' HG2' ' A' ' 145' ' ' GLU . 34.3 mttm -71.5 -29.37 64.73 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 81.4 mt -65.22 -41.72 94.13 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.787 0.803 . . . . 0.0 109.484 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.614 ' CD1' ' HB3' ' A' ' 64' ' ' TYR . 70.8 mt -72.58 -52.2 16.5 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.879 -178.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.705 ' HG2' ' HA ' ' A' ' 142' ' ' LYS . 24.1 pt-20 -69.28 -10.19 56.69 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.909 -172.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -72.49 26.6 0.72 Allowed Glycine 0 CA--C 1.523 0.545 0 C-N-CA 120.893 -0.67 . . . . 0.0 113.137 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' HIS . . . . . 0.435 ' H ' ' C ' ' A' ' 145' ' ' GLU . 31.5 t-80 -121.85 -0.85 9.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.452 0.644 . . . . 0.0 109.575 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' HIS . . . . . 0.689 ' HB3' ' O ' ' A' ' 152' ' ' HIS . 26.0 t60 -162.3 173.77 13.73 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 -177.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 12.7 p-80 -154.22 80.78 1.12 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 119.893 1.224 . . . . 0.0 113.456 178.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -151.88 -70.96 0.16 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.904 171.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -118.6 -37.08 3.35 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.34 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' HIS . . . . . 0.689 ' O ' ' HB3' ' A' ' 148' ' ' HIS . 11.1 t-80 . . . . . 0 C--O 1.24 0.576 0 CA-C-N 114.232 -1.349 . . . . 0.0 108.518 175.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.402 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.482 1.142 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 m -54.59 -42.58 71.26 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 171.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -90.58 127.34 36.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.751 164.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -141.14 137.48 32.78 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.905 0.383 . . . . 0.0 110.4 -177.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 44.2 mm -118.33 112.12 37.85 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.175 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -59.75 115.75 2.83 Favored 'Trans proline' 0 CA--C 1.517 -0.374 0 C-N-CA 123.248 2.632 . . . . 0.0 114.06 176.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.01 -89.88 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.172 -1.376 . . . . 0.0 111.424 173.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -88.02 47.37 1.49 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.149 0.5 . . . . 0.0 111.178 -176.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -138.57 -164.86 1.71 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.047 -177.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 19.3 mm -71.42 4.79 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 122.126 0.965 . . . . 0.0 111.007 -176.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -157.13 128.61 6.95 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.522 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -100.82 -161.05 0.83 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.23 68.44 0.5 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.065 0.46 . . . . 0.0 112.229 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 97.8 p -104.41 -17.8 14.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.449 0.642 . . . . 0.0 109.52 174.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.565 HD12 ' O ' ' A' ' 124' ' ' ASN . 2.4 tt -158.69 141.11 5.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.869 176.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.7 mp -107.05 114.08 45.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 171.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.47 108.46 14.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.119 0.485 . . . . 0.0 109.953 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 29' ' ' SER . 7.0 mt -94.93 124.9 47.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.612 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -120.97 99.21 6.37 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.546 -177.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.468 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 43.3 mt -131.09 159.1 38.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.9 mttp -90.19 142.57 27.58 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.04 0.448 . . . . 0.0 111.904 -178.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.58 ' OD1' ' HG2' ' A' ' 24' ' ' LYS . 15.9 t70 -75.88 176.89 7.41 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.092 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.92 HD11 ' HB3' ' A' ' 87' ' ' ALA . 3.0 mm? -46.81 -39.77 12.49 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 123.608 0.763 . . . . 0.0 110.889 177.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.58 ' HG2' ' OD1' ' A' ' 22' ' ' ASP . 30.6 mmtm -60.08 -48.92 79.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.954 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 9.62 3.97 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.831 -0.907 . . . . 0.0 110.831 -176.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.438 ' OD1' ' HB3' ' A' ' 22' ' ' ASP . 2.2 p30 -103.5 130.72 50.93 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.8 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.602 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 42.2 m -70.08 128.95 38.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.206 0.527 . . . . 0.0 111.313 -178.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.546 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 15.3 mmm180 -112.18 132.99 54.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.984 175.289 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.7 p -121.53 163.49 18.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.785 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.474 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 73.6 mt -76.11 -28.78 57.63 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 177.443 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 p -67.14 -14.58 63.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.371 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.02 -32.01 19.02 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.533 ' HB3' HG21 ' A' ' 38' ' ' VAL . 4.0 mp -90.71 10.04 27.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.905 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.665 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.4 ttmm -72.86 128.25 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.137 0.494 . . . . 0.0 110.372 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.07 -20.38 9.17 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 -172.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -109.22 168.71 9.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.922 -0.639 . . . . 0.0 110.376 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.833 HG23 ' HD2' ' A' ' 122' ' ' ARG . 80.6 t -91.34 118.58 36.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 169.036 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.732 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 95.2 t -111.5 131.38 62.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 121.716 0.769 . . . . 0.0 112.129 -169.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.9 tt -92.27 110.0 21.39 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.159 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.648 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 3.0 mp -84.19 106.49 14.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 175.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.624 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 26.1 t0 -98.55 144.74 27.54 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.601 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.539 ' HB3' HD21 ' A' ' 114' ' ' LEU . 21.7 m-85 -133.41 105.85 7.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 175.313 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.9 t -154.18 155.82 35.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.148 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.511 HG13 HD23 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -96.79 118.89 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.139 172.721 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.402 ' HD1' ' OG ' ' A' ' 75' ' ' SER . 17.7 m-85 -66.71 87.77 0.13 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 170.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 177.82 -35.51 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.102 -1.408 . . . . 0.0 109.157 -168.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -89.01 142.3 27.76 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.207 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.42 -29.81 64.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.961 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.4 mmm -64.32 -20.13 65.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.602 0.239 . . . . 0.0 111.337 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.4 t -64.99 -27.16 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.31 -50.17 61.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.388 . . . . 0.0 110.598 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.36 -29.41 69.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.418 0.627 . . . . 0.0 110.314 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.564 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 62.5 t60 -68.08 -47.38 68.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.5 176.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.577 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.2 m-20 -65.37 -27.14 68.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.985 178.469 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.76 -53.68 54.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.407 0.622 . . . . 0.0 109.886 174.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.95 74.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.662 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 54' ' ' ASN . 93.2 mt -63.92 -39.57 94.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.882 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -64.23 -26.04 68.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.728 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 5.1 tt0 -78.02 -50.46 12.06 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -177.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 63' ' ' LYS . 19.0 mt -53.72 -34.47 58.97 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 112.448 -2.16 . . . . 0.0 111.179 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.462 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 35.5 t80 -67.67 -45.76 74.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.275 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -68.04 -21.28 65.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.998 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.561 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 60.7 mttm -85.49 -61.15 1.83 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.679 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.583 ' HB3' HD11 ' A' ' 144' ' ' LEU . 66.8 m-85 -106.27 -14.8 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -163.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.548 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.35 169.7 11.78 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.92 -177.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 24.7 m 72.82 -35.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.386 0.675 . . . . 0.0 111.46 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 65' ' ' ALA . 47.6 mt-30 -81.87 11.03 5.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 110.944 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.4 47.53 1.3 Allowed Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.669 -176.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.548 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 64.5 t80 -141.43 134.65 29.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -143.55 150.05 38.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.499 HD12 ' CE3' ' A' ' 92' ' ' TRP . 58.5 mt -110.36 127.38 67.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.075 0.464 . . . . 0.0 110.299 -177.164 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.487 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.8 t80 -119.56 100.59 7.37 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.495 -176.179 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.624 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 44.1 mt-30 -93.29 117.01 29.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.234 -175.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.47 HD11 ' CE2' ' A' ' 72' ' ' TYR . 16.7 mm -86.58 113.96 25.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.651 171.542 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.402 ' OG ' ' HD1' ' A' ' 45' ' ' TYR . 42.2 t -105.11 111.6 24.42 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.334 0.588 . . . . 0.0 110.781 179.136 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.521 HD13 ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -102.74 39.3 1.55 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.548 177.047 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.482 ' HA ' HG12 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -50.31 -73.77 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.289 -1.323 . . . . 0.0 113.621 -173.697 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 124.94 -7.07 8.24 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 111.107 -0.797 . . . . 0.0 111.107 -172.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -142.34 119.12 11.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 20.9 tt0 -68.08 -41.74 81.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.955 -173.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 -79.9 -24.33 41.2 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -168.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -70.95 -48.83 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.569 ' CZ2' HD13 ' A' ' 23' ' ' LEU . 12.5 t90 -61.83 -47.07 86.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.891 176.238 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.915 ' HA ' HD12 ' A' ' 23' ' ' LEU . 60.3 tttt -62.13 -44.27 97.01 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.4 p -69.75 -41.09 75.67 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.91 0.386 . . . . 0.0 111.397 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.7 p -76.7 -42.79 40.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.857 -176.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.92 ' HB3' HD11 ' A' ' 23' ' ' LEU . . . -79.57 -24.63 41.96 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -171.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.4 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 24.6 t70 -71.8 -8.78 56.34 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.506 0.67 . . . . 0.0 110.442 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -101.8 9.94 40.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.119 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.862 ' HG ' ' O ' ' A' ' 87' ' ' ALA . 3.7 pp -98.44 158.2 33.03 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.968 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.764 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 32.5 Cg_endo -85.03 -3.06 9.66 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 124.062 3.174 . . . . 0.0 114.693 -172.06 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.835 ' CD1' HD13 ' A' ' 90' ' ' LEU . 2.4 p90 -122.55 -153.64 0.56 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.546 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 83.9 t -103.28 134.3 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -177.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.463 ' HB3' HD21 ' A' ' 23' ' ' LEU . 39.1 t -137.93 112.86 9.06 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.45 0.643 . . . . 0.0 109.539 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.468 ' CG2' ' HB2' ' A' ' 20' ' ' LEU . 27.4 m -114.6 148.07 17.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.896 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.478 ' HD2' ' CE3' ' A' ' 83' ' ' TRP . 36.1 ttt180 -100.24 137.49 38.61 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.92 0.391 . . . . 0.0 111.215 -174.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -87.09 146.01 26.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.265 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.64 -28.36 30.77 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 4.8 m-20 -91.53 -13.83 31.42 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -171.128 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 54.84 72.75 0.5 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.451 -0.404 . . . . 0.0 113.357 176.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.502 ' N ' ' HB2' ' A' ' 76' ' ' LEU . . . 78.2 -15.81 0.72 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.721 0.808 . . . . 0.0 111.858 177.17 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.54 25.24 5.89 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.443 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.9 OUTLIER -66.47 135.13 53.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.116 -176.393 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.616 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 26.2 m -55.65 -36.3 66.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.517 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.55 -46.12 84.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.191 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.5 HG23 ' HB ' ' A' ' 111' ' ' VAL . 65.8 mt -57.54 -43.48 83.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.753 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -67.59 -32.25 72.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.103 176.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 104' ' ' SER . 84.9 mt -65.7 -39.71 91.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.278 -179.465 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.423 ' O ' ' CB ' ' A' ' 110' ' ' ASN . 65.2 m-85 -77.12 -50.96 11.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.558 175.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.423 ' CB ' ' O ' ' A' ' 109' ' ' TYR . 8.6 t30 131.98 -43.31 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 O-C-N 125.525 1.766 . . . . 0.0 108.226 -176.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.5 ' HB ' HG23 ' A' ' 106' ' ' ILE . 0.4 OUTLIER 13.39 -86.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 O-C-N 125.428 1.705 . . . . 0.0 114.178 -174.298 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 112' ' ' THR . . . . . 0.435 ' H ' ' HB ' ' A' ' 111' ' ' VAL . 31.1 m 70.98 -52.99 0.68 Allowed 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.76 -173.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -95.2 76.82 3.45 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 121.187 0.517 . . . . 0.0 111.985 -175.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.539 HD21 ' HB3' ' A' ' 42' ' ' PHE . 2.4 mp -74.88 162.8 71.99 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.615 168.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.401 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 4.9 Cg_exo -73.78 159.03 98.16 Favored 'Cis proline' 0 C--N 1.35 0.646 0 C-N-CA 123.249 -1.563 . . . . 0.0 112.053 0.149 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.8 m -145.81 175.76 10.17 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.567 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.9 p -143.11 155.12 17.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.648 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 93.3 m-85 -133.8 155.63 49.46 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.983 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 5.1 tp -118.41 143.93 46.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.318 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.735 HG12 ' HA ' ' A' ' 126' ' ' LEU . 14.5 m -138.99 140.15 39.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.078 0.466 . . . . 0.0 110.115 167.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.576 ' HB3' HD22 ' A' ' 143' ' ' LEU . 1.2 p30 -89.49 178.29 6.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.859 -176.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.833 ' HD2' HG23 ' A' ' 37' ' ' VAL . 9.8 mmm180 -38.14 -48.2 1.22 Allowed 'General case' 0 N--CA 1.481 1.115 0 O-C-N 124.808 1.318 . . . . 0.0 113.813 -171.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.49 9.5 1.04 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.453 -176.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.665 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 1.6 t-20 54.28 57.95 5.4 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 123.594 0.758 . . . . 0.0 110.305 -171.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -128.09 140.15 52.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.716 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.735 ' HA ' HG12 ' A' ' 120' ' ' VAL . 3.8 tt -62.12 121.02 12.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.681 0.753 . . . . 0.0 111.295 -170.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.983 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 68.8 m -84.92 -54.58 4.57 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.436 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.497 ' HB1' ' OD1' ' A' ' 132' ' ' ASN . . . -168.98 173.6 6.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 -174.079 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.473 ' O ' HG13 ' A' ' 133' ' ' ILE . 89.7 mtt180 -110.58 158.83 18.14 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.805 -178.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.83 -14.99 32.71 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.06 173.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.25 -28.03 62.88 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 122.469 0.308 . . . . 0.0 111.033 176.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.497 ' OD1' ' HB1' ' A' ' 128' ' ' ALA . 24.6 p30 -127.57 -7.12 5.72 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.725 HG21 ' HG ' ' A' ' 136' ' ' LEU . 89.8 mt -78.8 108.63 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.564 ' HD2' ' H ' ' A' ' 134' ' ' LYS . 0.1 OUTLIER -58.42 -51.11 71.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.797 0.808 . . . . 0.0 110.009 178.122 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.557 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 9.8 t70 -154.38 124.91 6.99 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.137 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.725 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.7 mp -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.74 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -48.55 -52.69 21.46 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 123.051 0.219 . . . . 0.0 111.409 174.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -69.66 -38.79 77.22 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.321 0.581 . . . . 0.0 111.542 -179.156 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.649 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -62.81 -53.2 57.97 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.854 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.549 HG13 ' O ' ' A' ' 136' ' ' LEU . 41.7 mt -62.0 -32.03 53.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.271 0.558 . . . . 0.0 110.397 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -58.8 -43.08 90.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.412 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? -84.65 -18.84 34.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.203 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 30.8 mt -73.18 -41.84 63.4 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.25 178.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.583 HD11 ' HB3' ' A' ' 64' ' ' TYR . 21.1 mt -57.15 -49.72 75.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.434 0.635 . . . . 0.0 109.72 176.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -63.4 -53.35 53.74 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 114.374 -1.284 . . . . 0.0 111.454 179.236 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 85.25 98.22 0.7 Allowed Glycine 0 N--CA 1.441 -1.006 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 -172.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 64.5 t60 -66.12 -17.73 64.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.557 0.218 . . . . 0.0 111.465 -175.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 45.2 t60 -110.76 3.24 18.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.707 0.765 . . . . 0.0 109.542 174.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -92.16 -30.16 16.1 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 175.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -169.45 132.32 1.23 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 167.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -57.28 116.71 3.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.615 0.722 . . . . 0.0 111.986 -172.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 . . . . . 0 C--O 1.249 1.031 0 CA-C-N 115.228 -0.896 . . . . 0.0 108.839 174.787 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.0 mtm . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 110.426 -0.212 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.7 m 65.95 17.43 10.8 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.756 0.66 . . . . 0.0 111.474 174.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 36.0 mt -140.67 134.26 30.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.814 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -145.75 93.31 2.33 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 173.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 9.6 pt -115.47 133.79 22.71 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.334 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.516 ' HG2' ' HA ' ' A' ' 14' ' ' SER . 88.3 Cg_endo -85.83 24.29 0.77 Allowed 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.761 2.307 . . . . 0.0 112.014 178.337 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -119.28 80.97 1.64 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.342 174.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.89 -84.25 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.044 -176.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -133.05 -16.01 2.53 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.677 176.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 25.6 mm -131.27 156.84 43.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 114.152 -1.385 . . . . 0.0 109.365 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -63.3 104.96 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 173.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -153.62 103.74 2.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.897 0.38 . . . . 0.0 110.876 177.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 64.93 26.38 12.79 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.214 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.516 ' HA ' ' HG2' ' A' ' 6' ' ' PRO . 7.2 m -74.69 95.39 2.84 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 121.467 0.651 . . . . 0.0 110.413 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.805 HG13 ' HG ' ' A' ' 126' ' ' LEU . 12.1 tt -166.44 157.2 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.876 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.488 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.6 mp -101.5 109.03 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 172.08 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.437 ' HA ' HD12 ' A' ' 30' ' ' LEU . 25.8 t0 -73.51 131.97 42.36 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.434 HG23 ' CZ ' ' A' ' 105' ' ' TYR . 7.3 mt -113.29 111.58 36.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.138 -175.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.552 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.2 mp0 -98.87 100.16 11.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.296 178.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.95 154.39 51.12 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 89.7 mttt -85.34 143.19 28.81 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.925 0.393 . . . . 0.0 110.854 -175.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.4 p-10 -76.68 -167.13 0.76 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.929 -178.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.651 HD11 ' HG3' ' A' ' 84' ' ' LYS . 36.9 tp -56.67 -36.32 69.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -79.66 -33.52 41.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.675 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.457 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 116.49 20.24 5.13 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.065 -177.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -95.92 114.87 26.63 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 175.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.7 m -61.99 115.49 4.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.357 0.599 . . . . 0.0 111.182 178.024 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.552 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 18.8 mmm180 -92.27 142.1 27.84 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.501 175.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.5 p -120.1 159.5 24.7 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 172.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 17' ' ' ASP . 71.7 mt -80.91 -28.79 35.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.689 0.281 . . . . 0.0 111.229 -177.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.87 0.64 8.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.97 0.414 . . . . 0.0 111.241 175.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -83.45 -50.34 8.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.667 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.567 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -98.73 26.02 6.02 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.854 0.835 . . . . 0.0 110.277 -176.839 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.622 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 30.3 ttpt -59.47 -26.57 65.35 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 113.976 -1.465 . . . . 0.0 112.514 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -56.5 -21.72 35.8 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 116.279 -0.419 . . . . 0.0 113.866 -176.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.615 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -138.41 -169.66 2.64 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 116.859 0.329 . . . . 0.0 110.522 178.483 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.668 HG11 ' HB3' ' A' ' 143' ' ' LEU . 27.6 m -82.52 143.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 -176.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.551 HG22 ' HG ' ' A' ' 33' ' ' LEU . 21.5 t -119.98 137.89 52.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.975 -173.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.667 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.7 tp -102.66 106.2 16.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.969 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.636 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.2 mm -84.74 106.47 14.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.558 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 5.1 t70 -108.42 135.08 50.31 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.705 0.288 . . . . 0.0 111.032 -175.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.539 ' HB3' HD11 ' A' ' 76' ' ' LEU . 59.8 m-85 -123.13 99.92 6.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.068 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.565 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 15.8 m -138.81 149.66 45.19 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.018 0.437 . . . . 0.0 111.847 -170.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 47' ' ' ASN . 13.7 m -96.13 115.71 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 121.178 0.513 . . . . 0.0 110.755 176.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.536 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 36.7 m-85 -78.73 85.4 4.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.576 0.703 . . . . 0.0 109.477 176.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 178.25 -34.69 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.352 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.547 ' HB2' HG23 ' A' ' 44' ' ' VAL . 2.7 t-20 -84.04 163.45 19.89 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.698 -171.234 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.83 -30.4 40.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.339 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.6 tpt -62.5 -26.53 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.738 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 m -60.79 -34.13 74.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.141 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.64 -52.22 65.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.633 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.83 81.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.856 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.49 ' HE2' ' CG ' ' A' ' 41' ' ' ASP . 73.5 t60 -61.97 -51.57 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.81 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.572 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.0 m-20 -75.01 -18.01 60.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.589 -177.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 1.8 tm? -69.03 -51.34 40.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.02 -39.17 84.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.502 178.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.572 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.2 mt -60.65 -38.95 86.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.086 174.168 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 7.5 tpp180 -62.83 -27.83 69.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.563 179.128 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -78.13 -51.01 10.9 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.714 HD12 HD12 ' A' ' 140' ' ' ILE . 2.9 mm? -56.09 -32.27 63.99 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 112.735 -2.03 . . . . 0.0 111.07 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.503 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 30.5 t80 -70.21 -49.12 53.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.084 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -64.03 -21.41 66.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.654 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -84.05 -61.74 1.74 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.063 -177.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.515 ' HB3' HD11 ' A' ' 144' ' ' LEU . 84.9 m-85 -113.84 -18.2 11.86 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -166.023 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.47 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.57 161.5 29.45 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.004 -176.232 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.5 m 77.73 -34.76 0.2 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.529 0.732 . . . . 0.0 111.543 -177.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -85.24 11.04 10.79 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.068 177.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.612 ' O ' ' HB2' ' A' ' 36' ' ' LYS . . . 121.47 27.53 1.78 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.35 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.667 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 56.2 t80 -134.98 130.06 35.17 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 176.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.615 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 3.0 tt0 -133.3 156.26 47.92 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.261 178.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.477 HD12 ' CE3' ' A' ' 92' ' ' TRP . 54.2 mt -120.78 131.6 72.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.391 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.498 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 66.2 t80 -121.17 101.02 7.39 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.09 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.558 ' HG3' ' HB3' ' A' ' 41' ' ' ASP . 7.3 tt0 -105.91 145.76 30.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.014 0.435 . . . . 0.0 111.052 -176.317 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.423 HD11 ' HE2' ' A' ' 72' ' ' TYR . 46.5 mt -126.51 127.58 70.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.959 -177.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.536 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 2.6 p -85.34 121.81 28.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.962 0.41 . . . . 0.0 110.955 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.58 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 12.1 mt -110.39 9.07 23.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.387 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.497 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.0 OUTLIER -68.66 -68.71 0.38 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.05 -175.808 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.64 23.24 6.02 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -174.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -134.57 98.85 4.18 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.523 ' HG2' ' CE3' ' A' ' 83' ' ' TRP . 25.8 mt-10 -75.35 -14.47 60.48 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.677 -176.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -50.87 66.78 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.002 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -81.78 -30.48 32.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.225 -177.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.545 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 42.6 t90 -66.16 -52.0 52.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.097 175.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.651 ' HG3' HD11 ' A' ' 23' ' ' LEU . 19.1 ttmm -64.17 -43.47 95.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.934 -173.411 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.9 p -65.05 -43.24 92.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.666 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.428 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 38.1 t -74.46 -37.13 63.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.532 -178.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.566 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -69.91 -29.07 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -174.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.44 -23.02 66.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.305 0.574 . . . . 0.0 110.764 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -92.38 -8.18 45.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.83 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 86' ' ' SER . 34.8 mt -76.75 146.4 76.28 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.688 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 20.0 Cg_endo -91.25 -17.06 1.24 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 124.423 3.415 . . . . 0.0 113.523 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.688 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.4 p90 -115.93 -170.32 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.7 0.286 . . . . 0.0 110.94 -175.077 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.457 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 60.3 t -81.24 122.27 36.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.072 -176.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 49.8 t -125.8 109.31 12.39 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.957 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.489 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 17.2 m -117.63 158.75 18.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.892 -178.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.463 ' HA ' ' OG ' ' A' ' 75' ' ' SER . 19.0 ttp180 -107.91 136.23 47.97 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.139 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -80.77 155.54 26.63 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.55 -20.46 36.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.763 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.513 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 3.3 m-80 -122.19 -12.94 8.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.579 -173.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.58 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 70.97 -129.89 18.9 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.619 -0.8 . . . . 0.0 111.887 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.26 -5.63 29.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.851 0.357 . . . . 0.0 111.379 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -102.53 12.72 36.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.241 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.533 ' HB3' HG13 ' A' ' 106' ' ' ILE . 34.7 t -62.97 134.66 56.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.055 -177.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.505 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 8.0 m -61.26 -26.99 68.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.741 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.434 ' CZ ' HG23 ' A' ' 18' ' ' ILE . 64.1 m-85 -60.5 -45.09 95.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.611 178.283 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.533 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.6 mt -61.15 -36.0 69.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.508 -177.464 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.6 m -68.16 -35.64 78.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.724 178.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.5 mt -65.06 -35.25 80.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.439 -178.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.422 ' OH ' HD11 ' A' ' 18' ' ' ILE . 93.4 m-85 -74.24 -20.43 60.17 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.145 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 53.56 58.44 5.17 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -167.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.02 147.93 12.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.294 -1.321 . . . . 0.0 110.749 -176.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 10.5 m -86.95 -34.5 19.3 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.925 0.393 . . . . 0.0 110.927 178.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -170.42 166.19 8.54 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.659 HD23 ' HB2' ' A' ' 116' ' ' SER . 64.9 mt -142.46 159.08 59.11 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.565 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 20.4 Cg_exo -67.4 147.24 77.81 Favored 'Cis proline' 0 C--N 1.352 0.723 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.143 0.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.659 ' HB2' HD23 ' A' ' 114' ' ' LEU . 8.8 m -142.22 177.94 7.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.765 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.424 HG11 HD21 ' A' ' 136' ' ' LEU . 4.5 p -135.44 162.13 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.844 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.636 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 63.9 m-85 -138.78 160.22 40.21 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 175.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.846 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -110.44 139.0 46.08 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.473 -174.201 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.601 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 52.9 t -127.75 118.83 50.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.947 176.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.433 ' OD1' ' HB2' ' A' ' 125' ' ' GLU . 4.1 p-10 -76.75 162.63 27.52 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.987 176.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -69.78 27.82 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -167.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 121' ' ' ASN . 16.8 m120 -123.84 14.44 9.29 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 174.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.622 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 48.0 t30 53.24 61.66 3.04 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.168 -169.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 68.6 mt-10 -130.88 150.74 51.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.175 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.805 ' HG ' HG13 ' A' ' 15' ' ' ILE . 24.7 mt -72.37 119.67 16.91 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.125 0.488 . . . . 0.0 110.103 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.846 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 35.5 m -83.42 -51.26 7.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.344 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -170.02 172.78 6.31 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.02 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.498 ' O ' HG13 ' A' ' 133' ' ' ILE . 82.0 mtm180 -103.16 158.39 16.34 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.404 -176.108 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.4 -35.82 73.78 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 121.565 -0.35 . . . . 0.0 112.892 -175.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.489 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.5 pm0 -77.61 -7.08 55.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.117 178.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -105.0 -20.18 13.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.732 HG21 ' HG ' ' A' ' 136' ' ' LEU . 60.5 mt -97.49 138.86 21.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.375 -176.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.59 1.07 4.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.088 0.471 . . . . 0.0 110.032 177.28 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -144.87 48.93 1.3 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.51 -168.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.732 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.9 mp -56.43 -38.91 72.24 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -176.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.41 -53.33 57.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.39 . . . . 0.0 110.031 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.517 ' HA ' ' HE2' ' A' ' 141' ' ' LYS . 66.0 mm-40 -62.72 -39.56 94.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.942 175.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 1.042 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.59 -56.9 16.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.648 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.714 HD12 HD12 ' A' ' 60' ' ' LEU . 52.0 mt -56.33 -42.37 73.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.378 0.609 . . . . 0.0 110.492 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.5 ttpt -60.41 -42.43 95.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.447 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 1.042 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 36.5 pttt -80.24 -23.45 40.85 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 120.659 0.266 . . . . 0.0 111.036 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.668 ' HB3' HG11 ' A' ' 37' ' ' VAL . 82.5 mt -70.72 -40.54 72.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.715 176.321 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 90.9 mt -56.41 -53.41 57.7 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.921 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.54 -56.2 11.92 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.909 178.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 147' ' ' HIS . . . 60.57 69.06 1.4 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.463 -0.875 . . . . 0.0 111.355 -177.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' HIS . . . . . 0.478 ' HB2' ' O ' ' A' ' 146' ' ' GLY . 77.6 m-70 76.14 -57.9 0.55 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.553 0.741 . . . . 0.0 111.082 -176.014 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -175.11 -64.53 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.835 0.35 . . . . 0.0 111.027 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -76.86 136.83 38.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.808 0.813 . . . . 0.0 113.148 -168.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -177.06 45.16 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 113.749 -1.568 . . . . 0.0 107.15 174.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 46.4 t60 62.55 54.67 2.38 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 114.149 -1.387 . . . . 0.0 107.696 -163.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 36.8 t60 . . . . . 0 C--O 1.249 1.075 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.226 -172.668 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 pmm? . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.4 p -150.04 -73.49 0.17 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.18 0.514 . . . . 0.0 109.82 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 95.3 mt -130.76 142.87 50.43 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.226 174.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -87.12 105.11 16.96 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 61.2 mt -120.57 133.91 24.12 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.694 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.707 ' HG3' ' HB3' ' A' ' 13' ' ' ALA . 65.2 Cg_exo -48.97 159.8 0.86 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.141 2.561 . . . . 0.0 112.912 175.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -104.76 -41.36 5.68 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.727 -170.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.421 ' OD1' ' HG3' ' A' ' 9' ' ' LYS . 2.8 p30 -163.99 12.54 0.05 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.254 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.421 ' HG3' ' OD1' ' A' ' 8' ' ' ASP . 24.5 mttp -132.08 163.77 27.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.183 0.516 . . . . 0.0 110.378 178.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 pt -101.26 147.38 8.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 170.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 11' ' ' LYS . 26.1 ttpp 68.98 15.29 8.85 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.511 0.672 . . . . 0.0 110.927 177.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -95.55 -7.09 38.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.671 0.748 . . . . 0.0 109.752 175.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.707 ' HB3' ' HG3' ' A' ' 6' ' ' PRO . . . -177.42 -25.63 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.012 -1.449 . . . . 0.0 109.634 -176.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.77 -41.35 73.91 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.254 175.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.4 tp -169.15 138.03 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.122 178.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.496 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -101.16 105.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 176.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -76.11 111.07 11.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.257 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.4 HG22 ' HG ' ' A' ' 20' ' ' LEU . 13.2 mt -108.4 130.44 61.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.945 -177.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.541 ' HG3' ' HB3' ' A' ' 29' ' ' SER . 12.8 mp0 -111.56 100.7 9.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.514 -178.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.4 ' HG ' HG22 ' A' ' 18' ' ' ILE . 50.4 mt -130.06 154.64 47.23 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.509 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 92.8 mttt -88.79 146.57 24.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.804 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.747 ' OD2' ' HG2' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -85.45 -172.47 4.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 179.777 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.54 HD11 ' HG3' ' A' ' 84' ' ' LYS . 55.3 tp -51.43 -36.51 44.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.931 177.005 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.747 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 25.9 mmtm -72.79 -43.13 63.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.473 0.654 . . . . 0.0 110.012 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 125.62 11.16 4.17 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.665 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.491 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 20.5 m120 -83.43 113.33 20.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 178.111 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.509 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 16.1 m -64.55 107.35 1.37 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.118 0.485 . . . . 0.0 110.02 173.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.519 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 17.6 mmm180 -93.02 138.57 31.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.163 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.541 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 2.9 p -118.29 154.18 32.72 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 16' ' ' ILE . 82.3 mt -77.37 -30.98 54.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.853 0.358 . . . . 0.0 110.738 -176.262 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.41 ' HA ' ' ND2' ' A' ' 124' ' ' ASN . 12.5 t -74.89 0.24 16.27 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.141 0.496 . . . . 0.0 110.67 178.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -87.97 -51.23 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.446 ' O ' ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -85.17 12.38 8.02 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 122.057 0.932 . . . . 0.0 110.644 -176.455 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.45 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 25.9 ttpp -56.27 124.08 16.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.728 169.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.71 -40.12 1.17 Allowed Glycine 0 CA--C 1.495 -1.217 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -172.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HB2' ' C ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -119.27 173.67 6.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 172.592 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.641 HG23 ' HD1' ' A' ' 69' ' ' PHE . 17.1 m -75.87 136.37 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.947 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.416 HG22 ' HG ' ' A' ' 33' ' ' LEU . 33.0 t -116.76 123.69 71.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.94 -171.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.626 ' HB3' HG23 ' A' ' 71' ' ' ILE . 10.5 tp -87.17 112.7 22.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.751 175.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.612 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.3 mm -87.36 105.08 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 18.1 t70 -109.65 134.88 51.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.761 0.315 . . . . 0.0 111.033 -175.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.549 ' HB3' HD13 ' A' ' 114' ' ' LEU . 61.7 m-85 -122.35 99.1 6.24 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.899 ' O ' ' HA ' ' A' ' 75' ' ' SER . 20.6 m -139.71 143.68 37.17 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.107 0.48 . . . . 0.0 111.5 -169.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.695 HG13 ' HB2' ' A' ' 47' ' ' ASN . 3.4 p -96.81 120.96 46.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 O-C-N 121.978 -0.451 . . . . 0.0 110.138 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.599 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 48.3 m-85 -77.22 79.38 3.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.749 0.785 . . . . 0.0 109.46 176.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -178.75 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.884 -1.507 . . . . 0.0 109.112 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.695 ' HB2' HG13 ' A' ' 44' ' ' VAL . 38.5 t-20 -65.41 140.43 58.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.627 -179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.89 -35.43 80.63 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.484 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -67.85 -19.89 65.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.065 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 m -68.03 -29.09 67.99 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.138 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.6 -55.58 16.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.832 0.349 . . . . 0.0 110.851 -178.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.07 86.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 0.0 110.711 178.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.623 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 72.1 t60 -61.58 -38.99 89.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.952 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.49 ' HA ' HD12 ' A' ' 57' ' ' LEU . 21.7 t-20 -68.73 -30.33 68.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.544 0.211 . . . . 0.0 110.712 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tt -69.74 -41.84 74.73 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.27 80.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.388 176.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 76.6 mt -67.98 -39.44 83.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.481 176.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 58' ' ' ARG . 2.0 tpp180 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.13 -52.96 12.28 Favored 'General case' 0 CA--C 1.493 -1.237 0 CA-C-O 122.743 1.258 . . . . 0.0 108.08 -173.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.86 HD12 HD12 ' A' ' 140' ' ' ILE . 2.3 mm? -55.76 -31.7 62.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 112.219 -2.264 . . . . 0.0 110.888 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -75.25 -50.12 17.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.894 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -61.15 -22.03 64.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.529 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -81.67 -60.74 2.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.077 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -104.66 -7.69 19.43 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -166.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.544 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.88 165.8 16.88 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.491 -0.483 . . . . 0.0 111.169 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 56.9 m 70.89 -10.95 0.69 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.779 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -105.18 3.44 30.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.956 0.408 . . . . 0.0 110.729 179.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.546 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 114.3 45.73 0.66 Allowed Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.641 ' HD1' HG23 ' A' ' 37' ' ' VAL . 83.1 t80 -138.25 130.43 28.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.874 0.369 . . . . 0.0 110.822 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.44 ' HB3' ' HD3' ' A' ' 36' ' ' LYS . 22.4 tt0 -144.95 157.32 44.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.006 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.626 HG23 ' HB3' ' A' ' 39' ' ' LEU . 58.2 mt -127.45 136.43 60.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.305 -171.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.558 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 50.0 t80 -123.52 102.1 7.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.499 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.593 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.1 mt-30 -93.74 141.97 27.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 111.578 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.5 mt -122.26 122.17 65.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.038 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.899 ' HA ' ' O ' ' A' ' 43' ' ' THR . 78.7 p -99.73 142.01 31.78 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -175.308 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.747 HD11 HD12 ' A' ' 114' ' ' LEU . 81.5 mt -110.71 31.54 5.91 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.249 0.547 . . . . 0.0 109.565 172.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.558 ' HA ' HG23 ' A' ' 44' ' ' VAL . 5.3 p-10 -73.1 144.64 46.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.184 -173.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -108.31 16.7 34.97 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 164.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -125.69 94.6 4.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.151 -1.024 . . . . 0.0 109.278 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.416 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 32.0 tt0 -72.89 -27.06 61.66 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.227 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 -72.68 -32.85 66.12 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.766 -174.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -79.09 -40.53 30.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.535 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 39.9 t90 -61.11 -48.92 79.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.632 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.54 ' HG3' HD11 ' A' ' 23' ' ' LEU . 35.9 ttmt -62.46 -44.36 96.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.887 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 p -75.19 -34.25 61.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.359 . . . . 0.0 111.633 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.641 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 21.8 t -73.04 -44.99 60.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.449 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -67.55 -24.52 65.54 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.208 -178.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -63.39 -38.41 91.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.43 0.633 . . . . 0.0 109.709 176.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -93.99 11.41 29.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.969 -177.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 86' ' ' SER . 20.1 mt -97.64 133.68 23.29 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-O 121.535 0.683 . . . . 0.0 112.294 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.648 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 57.7 Cg_endo -80.45 -31.55 1.55 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 124.312 3.341 . . . . 0.0 113.071 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.648 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.8 p90 -100.77 -167.0 1.37 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.967 -173.817 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.558 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 54.1 t -81.68 132.72 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.782 -175.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.449 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -136.65 100.04 4.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.062 179.4 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.624 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 14.5 m -114.87 151.25 16.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.474 -175.336 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -107.88 137.44 45.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 0.0 111.882 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -92.14 135.43 33.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.036 174.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.77 -4.34 57.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -94.6 -14.78 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.721 -174.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 49.36 66.5 2.2 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.838 174.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.565 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 77.55 -5.17 2.18 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.414 0.685 . . . . 0.0 112.845 175.291 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -101.01 12.91 36.8 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.467 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.7 OUTLIER -61.96 126.59 27.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.89 -175.77 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.6 m -55.41 -28.88 56.96 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.372 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -61.3 -38.93 88.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.842 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.494 HG23 ' HB ' ' A' ' 111' ' ' VAL . 71.9 mt -59.66 -35.06 57.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.839 -178.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.7 m -73.86 -27.6 61.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.929 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.84 -37.81 67.31 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.089 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.788 ' HB2' HG23 ' A' ' 111' ' ' VAL . 91.7 m-85 -77.34 -8.51 57.78 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 121.135 -0.226 . . . . 0.0 110.598 178.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 38.4 t-20 54.96 51.71 13.1 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -169.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.788 HG23 ' HB2' ' A' ' 109' ' ' TYR . 94.1 t -69.5 128.52 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.024 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.815 -179.02 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 16.8 p -73.17 -48.48 35.0 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.495 177.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -176.5 135.53 0.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.794 176.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.747 HD12 HD11 ' A' ' 76' ' ' LEU . 72.1 mt -89.1 166.36 22.21 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.064 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.671 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 14.2 Cg_exo -69.35 159.44 88.4 Favored 'Cis proline' 0 C--N 1.354 0.833 0 C-N-CA 124.597 -1.001 . . . . 0.0 113.802 1.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 67.9 m -153.07 174.41 14.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.739 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.9 p -142.15 155.71 19.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.612 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.3 m-85 -136.02 161.88 34.44 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.792 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.2 tp -111.76 133.48 53.96 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 4.2 t -131.29 128.41 61.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.854 0.359 . . . . 0.0 110.322 174.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.558 ' HB3' HD22 ' A' ' 143' ' ' LEU . 2.7 p-10 -90.79 174.6 7.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.245 178.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -54.17 -23.23 13.58 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -166.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.54 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 28.0 m-20 -83.82 9.86 10.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.649 0.261 . . . . 0.0 110.513 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.45 ' HB2' ' HD3' ' A' ' 34' ' ' LYS . 28.3 t30 64.79 35.74 8.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.978 -174.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.54 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 43.9 mt-10 -109.48 138.04 46.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.025 -176.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.85 112.8 3.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.675 0.75 . . . . 0.0 110.85 176.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.792 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 45.7 m -78.01 -55.65 5.12 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.621 178.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.22 14.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.956 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.644 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 0.2 OUTLIER -99.31 159.37 15.05 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.218 178.649 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -55.69 -46.18 83.05 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 121.613 -0.327 . . . . 0.0 113.64 -175.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.644 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.0 OUTLIER -71.78 -29.66 64.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.261 0.553 . . . . 0.0 110.018 179.765 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.459 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -68.33 -39.53 81.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.613 177.318 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.826 HG21 ' HG ' ' A' ' 136' ' ' LEU . 75.3 mt -70.71 147.36 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.535 178.33 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HE3' ' HB3' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -140.71 108.5 5.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 171.904 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.488 ' OD1' ' HB3' ' A' ' 137' ' ' ASP . 15.7 t70 67.7 102.31 0.05 OUTLIER 'General case' 0 C--O 1.233 0.202 0 O-C-N 124.432 1.083 . . . . 0.0 109.867 -168.423 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.826 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.8 mp -75.13 -22.24 58.31 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.69 -177.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.488 ' HB3' ' OD1' ' A' ' 135' ' ' ASP . 9.7 t70 -52.73 -53.87 41.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.18 175.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.654 ' HB3' ' HE2' ' A' ' 142' ' ' LYS . 33.1 mm-40 -56.98 -50.4 72.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.331 173.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -53.89 -54.27 41.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.174 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.86 HD12 HD12 ' A' ' 60' ' ' LEU . 31.0 mt -67.11 -33.54 63.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.043 0.449 . . . . 0.0 110.928 -177.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -65.21 -32.78 74.63 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.402 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.654 ' HE2' ' HB3' ' A' ' 138' ' ' GLU . 54.1 mttm -80.46 -20.45 43.73 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.95 177.598 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.558 HD22 ' HB3' ' A' ' 121' ' ' ASN . 65.5 mt -73.6 -43.05 60.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.901 177.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 91.9 mt -63.77 -42.48 97.78 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.575 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -76.35 -15.0 60.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.411 177.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.69 61.2 3.66 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.045 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' HIS . . . . . 0.557 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 18.6 p-80 -68.47 96.78 0.71 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.422 0.63 . . . . 0.0 110.212 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -64.73 -34.27 77.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.372 -174.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -165.26 19.4 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.338 0.59 . . . . 0.0 110.644 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.557 ' O ' ' HB2' ' A' ' 147' ' ' HIS . 97.3 m-70 -135.1 -159.82 0.99 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 28.7 m80 -104.81 -174.54 2.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 169.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.202 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ptm . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -100.1 157.97 16.18 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 123.392 0.432 . . . . 0.0 110.356 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.444 ' HG ' HG12 ' A' ' 5' ' ' ILE . 41.5 tp -178.01 -29.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -178.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 56.66 50.94 11.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.257 173.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.444 HG12 ' HG ' ' A' ' 3' ' ' LEU . 47.1 mm -108.18 87.59 4.08 Favored Pre-proline 0 C--N 1.32 -0.691 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 169.067 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.53 165.03 6.47 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.044 2.496 . . . . 0.0 113.009 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.528 ' C ' ' H ' ' A' ' 9' ' ' LYS . 1.1 pt-20 -137.05 25.83 2.99 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.441 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -69.48 25.43 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.079 -175.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.565 ' HA ' ' CG ' ' A' ' 12' ' ' GLU . 27.5 mmtm 65.66 -156.34 0.27 Allowed 'General case' 0 C--O 1.234 0.276 0 C-N-CA 123.417 0.687 . . . . 0.0 110.7 175.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.9 mt 71.7 -71.23 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-O 121.415 0.626 . . . . 0.0 109.758 -171.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 11' ' ' LYS . 23.9 mmtp -136.46 0.14 2.48 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.048 172.292 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.565 ' CG ' ' HA ' ' A' ' 9' ' ' LYS . 47.4 mt-10 50.16 31.91 5.49 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.621 177.561 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -162.42 29.0 0.11 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.777 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.7 m -154.35 156.02 36.14 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.45 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 10.3 tt -52.77 152.7 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.913 175.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.674 ' H ' HD12 ' A' ' 16' ' ' ILE . 3.9 mp -74.75 103.79 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 173.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.79 108.17 9.63 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.1 mt -100.76 116.92 45.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.119 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.578 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 78.7 mt-30 -107.85 101.48 10.76 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.192 0.52 . . . . 0.0 110.82 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.838 ' HB2' HG11 ' A' ' 95' ' ' VAL . 29.6 mt -138.87 162.1 35.65 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.536 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 51.8 mttm -94.25 150.06 20.65 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.344 0.592 . . . . 0.0 111.435 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.57 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -81.24 -170.26 2.66 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.558 177.213 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.645 HD11 ' HE2' ' A' ' 84' ' ' LYS . 44.7 tp -54.82 -39.69 68.78 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.723 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 52.8 mttp -78.04 -26.95 48.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.445 -176.469 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 114.54 11.49 11.61 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.114 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.482 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 36.4 m-80 -82.79 110.45 17.83 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.536 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.3 m -68.27 113.55 5.98 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.521 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.6 mmm180 -103.42 139.58 38.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.037 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.578 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 82.4 p -120.48 160.3 23.42 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.585 HD12 ' O ' ' A' ' 16' ' ' ILE . 63.4 mt -80.55 -25.29 38.7 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.745 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.7 p -66.49 -20.17 65.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 173.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -79.28 -40.86 29.44 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 122.232 1.015 . . . . 0.0 108.476 175.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 tp -78.29 6.26 8.64 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.824 -1.534 . . . . 0.0 110.879 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.729 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.5 ttmm -73.96 114.96 12.85 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.344 -177.03 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.61 -25.41 2.29 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -173.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.653 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -117.77 168.24 10.64 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.438 175.75 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.756 HG23 ' HD1' ' A' ' 69' ' ' PHE . 29.4 m -82.92 124.58 39.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 173.205 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.68 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 72.3 t -113.05 136.92 47.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.565 0.698 . . . . 0.0 112.101 -168.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 39' ' ' LEU . 9.4 tp -98.99 119.18 37.33 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.624 177.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.407 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 0.2 OUTLIER -97.12 104.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.903 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -107.68 135.0 49.84 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.613 ' O ' ' HA ' ' A' ' 115' ' ' PRO . 82.9 m-85 -119.04 101.62 8.16 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 75' ' ' SER . 1.1 t -128.63 -178.21 4.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.186 -172.221 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.67 HG13 ' HB3' ' A' ' 47' ' ' ASN . 0.4 OUTLIER -135.79 117.6 20.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.265 177.456 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.501 ' OH ' HD11 ' A' ' 90' ' ' LEU . 32.0 m-85 -78.64 80.07 5.03 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.546 0.689 . . . . 0.0 110.689 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -179.67 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.757 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.67 ' HB3' HG13 ' A' ' 44' ' ' VAL . 4.6 t30 -77.51 132.71 38.51 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.562 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.05 -26.68 68.36 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.475 -173.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.91 -32.5 72.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.304 0.573 . . . . 0.0 109.603 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.3 m -68.22 -27.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.733 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.1 43.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.743 0.306 . . . . 0.0 111.042 -177.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.87 -34.09 76.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.48 . . . . 0.0 110.796 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.45 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 76.5 t60 -64.31 -38.75 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.578 ' HA ' HD12 ' A' ' 57' ' ' LEU . 6.2 m-20 -70.89 -18.83 62.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.615 -179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.2 tt -77.18 -41.75 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.025 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.76 82.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.373 0.606 . . . . 0.0 109.814 175.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.578 HD12 ' HA ' ' A' ' 54' ' ' ASN . 82.3 mt -65.36 -38.6 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.684 176.318 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.413 ' HA ' ' CZ3' ' A' ' 92' ' ' TRP . 5.9 tpp180 -61.89 -30.34 70.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.001 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -77.42 -51.61 10.5 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -174.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 140' ' ' ILE . 1.8 mm? -56.14 -29.79 61.24 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.675 -2.057 . . . . 0.0 111.625 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -78.71 -46.34 19.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.085 -177.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.35 -22.48 66.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.545 0.688 . . . . 0.0 110.68 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -82.86 -61.06 1.97 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.129 -0.941 . . . . 0.0 112.329 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.578 ' HB3' HD11 ' A' ' 144' ' ' LEU . 92.9 m-85 -112.24 -5.64 14.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -162.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.581 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.04 -36.94 75.87 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.207 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 m -70.22 -5.74 29.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.593 ' HB2' HD13 ' A' ' 144' ' ' LEU . 45.3 mt-30 -110.64 12.91 22.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.007 0.432 . . . . 0.0 111.292 -178.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.474 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 100.98 52.35 1.1 Allowed Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.786 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.756 ' HD1' HG23 ' A' ' 37' ' ' VAL . 43.3 t80 -131.12 134.34 46.47 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.653 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 10.6 tp10 -137.74 144.61 41.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.516 -177.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.426 HD12 ' CE3' ' A' ' 92' ' ' TRP . 60.3 mt -109.29 125.65 66.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.184 0.516 . . . . 0.0 110.426 177.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.521 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 85.6 t80 -111.0 102.02 10.53 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.54 -0.755 . . . . 0.0 108.974 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -95.31 134.45 38.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.252 -174.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.554 HD12 ' CE2' ' A' ' 42' ' ' PHE . 43.2 mt -120.11 112.16 35.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 0.0 110.059 174.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.418 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 30.1 t -91.11 140.66 29.61 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.7 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.645 HD11 HD12 ' A' ' 114' ' ' LEU . 16.6 mt -93.48 13.62 21.21 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.429 ' CG ' ' H ' ' A' ' 78' ' ' GLY . 5.2 p-10 44.13 -111.33 0.21 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.366 -1.288 . . . . 0.0 113.393 178.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.429 ' H ' ' CG ' ' A' ' 77' ' ' ASP . . . 92.75 -29.13 8.21 Favored Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 -170.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.73 119.51 11.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -72.58 -30.27 64.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.55 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -67.48 -57.07 7.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.391 -174.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -66.02 -38.31 88.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.397 -174.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.509 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 36.1 t90 -62.42 -48.11 81.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.645 ' HE2' HD11 ' A' ' 23' ' ' LEU . 3.2 ttmt -58.11 -54.89 41.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.488 -174.653 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -66.03 -33.74 76.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.916 -0.583 . . . . 0.0 112.194 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.532 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.2 t -83.38 -32.8 25.99 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.458 -177.167 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.422 ' HB3' HD22 ' A' ' 23' ' ' LEU . . . -75.82 -35.0 60.15 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.503 ' HB2' ' CD2' ' A' ' 23' ' ' LEU . 19.0 t70 -70.34 -28.46 65.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.035 -176.154 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -94.08 16.43 14.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.482 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' ' 94' ' ' CYS . 16.5 mt -88.71 148.32 41.42 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.36 0.6 . . . . 0.0 112.166 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.702 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.6 Cg_endo -76.04 -37.71 1.45 Allowed 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.693 2.929 . . . . 0.0 113.03 177.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.702 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 10.9 p90 -104.58 -167.91 1.41 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.778 -175.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.433 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 38.4 t -82.4 125.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.608 -175.209 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.572 ' HB2' HD12 ' A' ' 90' ' ' LEU . 30.8 t -121.91 108.78 13.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.241 0.543 . . . . 0.0 109.977 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.838 HG11 ' HB2' ' A' ' 20' ' ' LEU . 14.1 t -114.58 162.01 12.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.288 -172.08 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.438 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . 44.0 ttp180 -128.44 137.24 51.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 111.277 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -87.94 145.97 25.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.57 -24.64 45.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.089 0.471 . . . . 0.0 111.357 -176.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.54 32.18 5.7 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.917 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.489 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . -57.76 82.62 0.01 OUTLIER Glycine 0 C--N 1.342 0.876 0 O-C-N 123.757 0.66 . . . . 0.0 114.129 -173.103 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 167.24 -33.9 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.544 1.138 . . . . 0.0 108.561 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.92 12.07 5.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.97 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.52 ' HB3' HG13 ' A' ' 106' ' ' ILE . 41.9 t -62.99 135.85 57.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.604 -177.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.56 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.3 m -54.99 -37.24 66.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.13 -176.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -56.84 -56.48 21.07 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.301 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.769 HG22 HG11 ' A' ' 111' ' ' VAL . 11.5 mt -58.61 -33.74 49.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.664 -175.459 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 18.6 m -71.01 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.427 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 104' ' ' SER . 94.6 mt -64.55 -34.96 79.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.751 0.31 . . . . 0.0 110.977 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -77.69 -4.11 44.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.895 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 t30 56.46 65.88 1.32 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.883 0.849 . . . . 0.0 109.728 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.769 HG11 HG22 ' A' ' 106' ' ' ILE . 2.7 p -73.41 122.95 27.38 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.437 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.8 m -126.35 0.23 7.0 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.458 0.647 . . . . 0.0 109.64 173.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASN . . . . . 0.404 ' O ' HD23 ' A' ' 114' ' ' LEU . 6.8 t30 -169.5 119.72 0.67 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.471 -178.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.645 HD12 HD11 ' A' ' 76' ' ' LEU . 36.2 mt -124.76 157.69 65.13 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 171.106 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.613 ' HA ' ' O ' ' A' ' 42' ' ' PHE . 43.6 Cg_endo -68.25 150.16 85.55 Favored 'Cis proline' 0 C--N 1.347 0.462 0 C-N-CA 123.84 -1.317 . . . . 0.0 114.234 1.066 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.1 m -136.44 164.35 28.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.207 174.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 p -133.7 152.45 34.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.048 0.452 . . . . 0.0 110.68 -176.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.469 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 71.5 m-85 -133.77 152.1 51.78 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.356 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.633 HD13 HD11 ' A' ' 136' ' ' LEU . 35.4 tp -111.85 142.98 43.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.123 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.68 ' CG2' ' HB ' ' A' ' 38' ' ' VAL . 4.6 m -136.56 146.3 28.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 169.111 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.407 HD21 ' HB2' ' A' ' 125' ' ' GLU . 10.0 p30 -83.38 171.91 13.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -177.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 8.9 ptp180 -65.16 -11.81 44.38 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -168.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -80.55 6.48 12.38 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 172.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.729 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 2.2 t-20 56.21 53.88 8.43 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.988 -173.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.45 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 75.1 mm-40 -129.98 143.95 51.07 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.625 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.646 ' HA ' HG12 ' A' ' 120' ' ' VAL . 2.6 tt -57.07 119.33 6.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.284 0.564 . . . . 0.0 110.954 -172.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.86 -51.84 5.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.161 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.51 171.56 7.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -176.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.571 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -99.09 163.83 12.41 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.638 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.411 ' HA2' HD12 ' A' ' 133' ' ' ILE . . . -44.42 -42.52 7.2 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 -175.134 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -41.42 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 117.27 0.535 . . . . 0.0 110.948 -177.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -63.48 -27.97 69.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.167 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.833 HG21 HD22 ' A' ' 136' ' ' LEU . 90.0 mt -68.24 -33.28 59.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.604 178.302 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.602 ' NZ ' ' HB2' ' A' ' 134' ' ' LYS . 5.1 mtmp? 72.09 -55.3 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.444 0.698 . . . . 0.0 110.263 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -154.47 124.68 6.84 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.508 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.833 HD22 HG21 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -66.98 -42.98 84.16 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.678 -173.516 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.55 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.0 t70 -52.14 -51.28 58.92 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.107 0.479 . . . . 0.0 109.961 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.28 -50.54 50.09 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.4 175.298 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.494 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -71.6 -46.81 58.14 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -173.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ILE . . . . . 0.873 HD12 HD12 ' A' ' 60' ' ' LEU . 36.4 mt -59.04 -36.52 62.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 0.0 110.379 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -59.35 -49.47 77.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.451 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -75.51 -21.53 57.92 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.711 -178.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' LEU . . . . . 0.559 ' HB3' HG11 ' A' ' 37' ' ' VAL . 86.2 mt -69.59 -40.36 76.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.333 0.587 . . . . 0.0 110.436 175.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.593 HD13 ' HB2' ' A' ' 67' ' ' GLN . 73.2 mt -81.96 -55.74 4.4 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.253 179.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.408 ' HA ' ' OE1' ' A' ' 145' ' ' GLU . 6.4 mm-40 -77.13 1.63 17.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.042 -175.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -65.67 -45.45 89.11 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.199 172.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' HIS . . . . . 0.447 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 96.9 m-70 62.15 -0.45 0.48 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 173.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 43.1 t-80 69.27 -74.73 0.08 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.483 0.713 . . . . 0.0 112.642 171.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -104.96 4.32 31.66 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.28 0.562 . . . . 0.0 110.81 -174.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' HIS . . . . . 0.447 ' O ' ' HB2' ' A' ' 147' ' ' HIS . 18.2 m-70 -145.15 176.54 9.45 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 173.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -135.11 177.01 8.14 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 118.138 0.426 . . . . 0.0 110.413 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 . . . . . 0 C--O 1.244 0.781 0 CA-C-O 118.407 -0.806 . . . . 0.0 109.214 175.002 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 121.166 0.508 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.52 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.9 mp -95.95 122.81 47.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.555 175.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.406 ' OD1' ' HB2' ' A' ' 29' ' ' SER . 26.2 t70 -87.08 106.17 17.68 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.69 ' O ' ' HA ' ' A' ' 29' ' ' SER . 13.0 mt -89.4 110.2 21.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.457 -173.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.523 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 34.3 mt-30 -105.59 100.03 9.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.196 0.522 . . . . 0.0 110.776 -178.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 97' ' ' ASP . 32.7 mt -140.22 151.01 44.84 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 174.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.684 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.9 mttm -90.89 155.34 18.82 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.037 -173.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 15.2 p30 -91.76 -172.6 3.26 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.03 -175.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.742 HD11 ' HA ' ' A' ' 84' ' ' LYS . 21.2 tp -57.31 -27.38 62.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.319 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.571 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 68.0 mttm -96.05 -12.5 24.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.062 0.458 . . . . 0.0 111.026 -175.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.91 -3.34 31.86 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.38 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.571 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 17.9 m-80 -72.26 118.76 15.55 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.6 m -73.08 106.21 4.85 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.209 -177.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.438 ' HA ' ' HD3' ' A' ' 28' ' ' ARG . 16.5 mmt180 -87.81 142.14 28.05 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.742 -177.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.69 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 31.9 p -135.33 159.76 40.55 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.912 ' HB3' HD21 ' A' ' 124' ' ' ASN . 47.0 mt -72.72 -21.35 61.05 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.446 0.641 . . . . 0.0 110.004 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.411 ' HA ' ' NZ ' ' A' ' 34' ' ' LYS . 3.6 p -73.17 -15.5 61.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.144 172.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.437 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t70 -87.37 -40.12 14.7 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.751 0.786 . . . . 0.0 109.467 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.683 HD23 HG13 ' A' ' 38' ' ' VAL . 7.8 tp -86.6 15.81 5.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.281 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.6 ' HB2' ' HZ2' ' A' ' 34' ' ' LYS . 4.4 ttmp? -66.76 -11.17 53.76 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.332 0.587 . . . . 0.0 111.517 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.21 -20.58 71.32 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.625 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.669 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 76.7 mttt -129.95 178.8 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.791 HG23 ' HD1' ' A' ' 69' ' ' PHE . 19.6 m -81.02 129.0 38.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 166.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.683 HG13 HD23 ' A' ' 33' ' ' LEU . 24.1 t -101.68 121.62 52.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.123 0.487 . . . . 0.0 111.868 -168.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.407 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 14.5 tp -88.41 116.18 26.46 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.366 173.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.557 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 10.0 mm -90.08 105.25 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.497 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 10.3 t70 -106.99 130.3 54.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.922 0.391 . . . . 0.0 110.902 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.699 ' HB3' HD11 ' A' ' 76' ' ' LEU . 66.5 m-85 -121.3 100.74 7.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.839 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 t -146.64 176.39 9.87 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.625 -178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.507 ' HB ' ' HB3' ' A' ' 77' ' ' ASP . 5.2 m -111.06 119.49 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.135 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.728 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 43.8 m-85 -74.42 83.52 1.96 Allowed 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 173.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 177.45 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.933 0.873 . . . . 0.0 109.791 -168.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.448 ' HB2' HG23 ' A' ' 44' ' ' VAL . 9.0 t-20 -95.04 142.52 27.42 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.06 -1.427 . . . . 0.0 110.837 -167.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -29.53 66.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.437 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.9 ptp -65.98 -22.08 66.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.011 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 t -73.33 -29.73 62.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.54 -52.17 62.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.119 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.26 -37.0 80.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.746 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.471 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 78.6 t60 -64.84 -36.79 85.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.394 178.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.558 ' HA ' HD12 ' A' ' 57' ' ' LEU . 21.5 t-20 -67.17 -32.14 73.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.751 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tt -65.45 -42.74 92.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.972 0.415 . . . . 0.0 109.925 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.87 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.298 0.57 . . . . 0.0 110.368 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.558 HD12 ' HA ' ' A' ' 54' ' ' ASN . 62.7 mt -69.03 -40.46 78.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.757 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 58' ' ' ARG . 9.3 tpt180 -60.48 -30.12 69.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.192 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -76.4 -52.03 10.69 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.849 HD12 HD12 ' A' ' 140' ' ' ILE . 2.2 mm? -57.43 -27.84 62.76 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 112.681 -2.054 . . . . 0.0 111.415 178.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -76.29 -46.57 27.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.007 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.4 -22.18 65.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.247 0.546 . . . . 0.0 110.547 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.543 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 37.3 mttm -77.39 -61.16 2.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.035 -179.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 141' ' ' LYS . 95.8 m-85 -115.17 -8.05 12.4 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -164.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.565 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.89 -36.05 76.14 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.176 0.444 . . . . 0.0 111.491 -176.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.0 m -64.43 -19.99 65.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.646 -178.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -102.98 2.39 34.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.678 0.275 . . . . 0.0 111.267 -176.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 112.54 55.58 0.46 Allowed Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.567 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.791 ' HD1' HG23 ' A' ' 37' ' ' VAL . 31.4 t80 -131.54 143.33 50.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.669 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.75 148.24 38.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.976 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.536 HD13 ' HB3' ' A' ' 57' ' ' LEU . 56.9 mt -107.69 117.86 54.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.144 0.497 . . . . 0.0 110.066 176.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -99.32 99.32 10.25 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 43.9 tt0 -102.45 123.77 46.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.14 -172.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 49.6 mt -105.69 125.24 61.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.612 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.728 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 4.0 p -84.95 121.91 28.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.786 176.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.699 HD11 ' HB3' ' A' ' 42' ' ' PHE . 16.8 mt -106.52 5.74 29.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.284 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.509 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.1 p-10 -68.81 -60.93 2.04 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.162 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.55 32.73 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -178.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.478 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 33.8 t70 -113.16 104.18 12.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.375 0.607 . . . . 0.0 110.728 -178.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 31.0 mt-10 -68.78 -14.35 62.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.934 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . 0.478 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 61.0 m80 -66.49 -59.35 3.73 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.624 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -74.43 -34.46 63.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.276 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -60.8 -53.38 58.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.955 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.742 ' HA ' HD11 ' A' ' 23' ' ' LEU . 19.3 ttmt -63.87 -41.62 97.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.689 0.281 . . . . 0.0 111.391 -173.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -69.75 -41.46 75.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.84 0.353 . . . . 0.0 111.548 -177.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -75.54 -47.56 26.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.369 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.655 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -67.79 -27.16 66.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.833 -174.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -58.54 -27.26 64.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.25 0.548 . . . . 0.0 111.429 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -108.67 13.0 25.44 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.773 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.7 mt -90.37 144.69 31.27 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 111.718 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.627 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 60.5 Cg_endo -70.25 -52.81 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.688 2.925 . . . . 0.0 113.518 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.627 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.8 p90 -87.41 -169.02 2.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.144 -171.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.8 t -80.96 126.83 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.849 -173.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.655 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 2.0 p -123.73 108.65 12.76 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.508 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 19.7 m -121.43 172.17 8.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.233 -178.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -125.57 144.36 50.6 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.984 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.49 ' HA ' HD13 ' A' ' 20' ' ' LEU . 19.8 t70 -81.6 168.74 17.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.903 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.28 -38.33 27.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.252 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.424 ' CG ' ' HB2' ' A' ' 102' ' ' TYR . 7.3 t-20 -122.97 -11.77 8.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.008 0.432 . . . . 0.0 111.339 -175.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.552 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 78.64 -108.91 2.74 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.472 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.01 -23.94 64.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.079 0.466 . . . . 0.0 110.858 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.424 ' HB2' ' CG ' ' A' ' 99' ' ' ASN . 55.6 m-85 -99.08 29.16 4.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.804 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.488 ' HB3' HG13 ' A' ' 106' ' ' ILE . 37.1 t -60.15 140.0 57.19 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.507 -178.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.562 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.5 m -63.36 -31.26 72.37 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.745 174.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -67.19 -48.82 66.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.995 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.591 HD11 HD13 ' A' ' 76' ' ' LEU . 58.9 mt -53.71 -38.03 33.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.623 175.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 20.4 m -68.61 -39.56 80.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.742 177.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.8 mt -68.59 -38.72 80.9 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.62 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.536 ' OH ' HD11 ' A' ' 18' ' ' ILE . 89.1 m-85 -69.8 -30.56 68.13 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.818 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.461 0.121 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -165.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.462 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 3.6 mm? . . . . . 0 CA--C 1.537 0.478 0 CA-C-O 121.059 0.457 . . . . 0.0 111.708 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.462 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 52.7 Cg_endo -70.56 162.09 87.1 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.239 -1.567 . . . . 0.0 111.716 -0.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.6 t -147.89 176.66 9.97 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.221 0.534 . . . . 0.0 110.748 -176.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.509 HG12 ' HA3' ' A' ' 130' ' ' GLY . 2.8 p -142.82 154.7 17.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 175.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.557 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.3 m-85 -143.3 158.17 43.86 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.965 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.5 tp -112.33 143.87 42.7 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.64 -173.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.531 HG11 HD22 ' A' ' 124' ' ' ASN . 2.8 t -140.95 131.69 27.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.035 172.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.584 ' HB3' HD22 ' A' ' 143' ' ' LEU . 3.9 p-10 -96.62 176.98 5.81 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.366 176.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.456 ' N ' HG12 ' A' ' 37' ' ' VAL . 84.0 mtt-85 -43.33 -42.56 4.59 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -166.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.561 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 75.3 m-20 -78.95 12.73 2.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 121.995 -0.441 . . . . 0.0 110.457 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.912 HD21 ' HB3' ' A' ' 30' ' ' LEU . 2.3 t-20 61.18 44.12 10.32 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.487 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.561 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 87.4 mt-10 -96.23 133.13 40.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.288 177.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.7 tt -72.34 107.94 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.965 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 63.8 m -71.66 -55.49 7.62 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.291 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 178.95 173.04 0.77 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.037 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.579 ' HD3' ' OE2' ' A' ' 131' ' ' GLU . 76.4 mtt180 -83.3 159.28 21.93 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.745 176.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.509 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -62.81 -34.33 89.47 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 111.747 -0.541 . . . . 0.0 111.747 175.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.579 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 2.0 mp0 -64.19 -25.39 68.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.248 0.547 . . . . 0.0 110.356 177.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -90.69 -26.86 19.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.315 0.579 . . . . 0.0 110.194 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.588 ' CD1' ' HB2' ' A' ' 119' ' ' LEU . 23.4 mt -99.11 94.79 3.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.147 -175.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.17 11.71 24.67 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.227 173.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -143.43 41.4 1.47 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.283 -170.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.577 ' HA ' ' HB3' ' A' ' 139' ' ' ALA . 3.7 mp -53.66 -35.37 60.95 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -176.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.582 ' HA ' HD11 ' A' ' 60' ' ' LEU . 24.0 t70 -54.53 -58.41 7.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.738 0.304 . . . . 0.0 110.551 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 4.4 mm-40 -65.68 -32.61 74.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 111.916 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.716 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.68 -56.01 24.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.618 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.849 HD12 HD12 ' A' ' 60' ' ' LEU . 48.2 mt -61.47 -34.98 63.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.143 0.497 . . . . 0.0 110.108 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 64' ' ' TYR . 25.6 tttm -60.0 -53.41 58.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.896 176.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 138' ' ' GLU . 13.8 pttm -67.27 -27.34 67.12 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 48.3 mt -64.22 -42.12 96.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.669 0.747 . . . . 0.0 110.027 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.423 HD22 ' NH2' ' A' ' 122' ' ' ARG . 88.0 mt . . . . . 0 C--N 1.322 -0.615 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.987 178.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.516 HG21 ' O ' ' A' ' 124' ' ' ASN . 9.4 pt . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.553 ' O ' HD12 ' A' ' 30' ' ' LEU . 79.5 mt -121.66 103.52 13.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 174.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -104.23 130.81 52.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.527 HG22 ' HG ' ' A' ' 20' ' ' LEU . 14.6 mt -116.76 121.47 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.228 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.558 ' HG3' ' HB3' ' A' ' 29' ' ' SER . 1.7 mp0 -98.08 101.75 13.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.732 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.527 ' HG ' HG22 ' A' ' 18' ' ' ILE . 33.7 mt -132.03 155.6 47.74 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 50.7 mttm -86.94 151.07 23.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.934 0.397 . . . . 0.0 110.793 178.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.643 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -85.39 -177.53 6.49 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.404 175.075 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.876 HD21 ' HB3' ' A' ' 87' ' ' ALA . 1.0 OUTLIER -53.89 -36.73 63.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.546 0.689 . . . . 0.0 112.005 179.346 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HB2' HD22 ' A' ' 26' ' ' ASN . 39.5 mttp -78.22 -18.91 54.8 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.718 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 107.69 9.28 28.97 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.474 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.466 HD22 ' HB2' ' A' ' 24' ' ' LYS . 42.5 m-80 -81.57 108.86 15.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.479 0.18 . . . . 0.0 110.899 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.625 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 62.6 m -68.32 110.22 3.98 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.482 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 5.8 mmm180 -104.38 130.71 52.23 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.991 0.424 . . . . 0.0 110.329 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.558 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 45.7 p -104.31 159.04 16.04 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 169.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 16' ' ' ILE . 50.7 mt -69.6 -26.0 64.24 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.487 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.4 p -68.55 -16.29 63.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.73 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.502 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -78.55 -24.83 45.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 122.295 1.045 . . . . 0.0 108.913 176.788 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.606 HD23 HG13 ' A' ' 38' ' ' VAL . 1.5 tp -99.18 6.08 46.54 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.133 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.515 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 51.0 tttm -69.77 144.53 52.67 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -176.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.73 -21.46 43.79 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 1.104 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 10.0 ttmt -124.07 155.8 37.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.425 -0.887 . . . . 0.0 108.859 178.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.793 HG23 ' HD1' ' A' ' 69' ' ' PHE . 26.9 m -81.59 140.3 16.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -176.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.606 HG13 HD23 ' A' ' 33' ' ' LEU . 32.2 t -122.56 129.02 75.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.27 0.557 . . . . 0.0 111.9 -169.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.603 HD22 HG23 ' A' ' 71' ' ' ILE . 7.0 tt -91.65 112.62 24.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.035 172.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.586 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 15.7 mm -91.03 105.75 16.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.235 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -109.67 139.77 44.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.987 0.423 . . . . 0.0 111.244 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.5 102.43 7.38 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.467 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.9 t -139.63 164.33 30.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.989 0.423 . . . . 0.0 111.62 -174.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.646 HG12 ' HA ' ' A' ' 77' ' ' ASP . 3.3 m -106.47 126.68 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.243 176.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.558 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 21.5 m-85 -87.8 83.42 7.13 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 -177.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.527 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 3.9 m-20 177.14 -50.03 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 114.666 -1.152 . . . . 0.0 108.585 -177.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.595 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.1 t30 -70.26 133.13 46.71 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.285 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.88 -24.63 38.29 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.557 -173.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.6 mtt -59.76 -26.69 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.851 177.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -75.8 -40.97 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.432 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.47 -59.25 5.26 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.771 -175.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.89 71.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.707 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.496 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 t60 -65.19 -45.37 85.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.793 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.512 ' HA ' HD12 ' A' ' 57' ' ' LEU . 89.5 m-20 -69.07 -25.21 64.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.154 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.6 tt -73.09 -44.9 59.79 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.52 -35.34 74.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.36 0.6 . . . . 0.0 110.03 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -67.07 -37.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.867 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.424 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 10.1 tpp180 -60.95 -28.31 68.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.497 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -77.99 -53.75 7.07 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 122.666 1.222 . . . . 0.0 107.879 -177.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.757 HD12 HD12 ' A' ' 140' ' ' ILE . 2.4 mm? -55.36 -29.1 57.74 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 112.282 -2.235 . . . . 0.0 111.506 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -75.54 -48.29 23.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.912 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -61.71 -21.89 64.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.251 0.548 . . . . 0.0 110.431 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -80.35 -57.57 3.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.319 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -108.17 -5.59 16.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -167.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.514 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -70.63 178.69 2.9 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.867 178.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.5 m 71.61 -35.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.326 0.65 . . . . 0.0 111.602 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.42 ' H ' ' C ' ' A' ' 65' ' ' ALA . 50.6 mt-30 -79.45 -0.49 33.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 111.114 178.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.589 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 110.71 47.53 0.78 Allowed Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.907 -0.664 . . . . 0.0 111.896 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.793 ' HD1' HG23 ' A' ' 37' ' ' VAL . 65.4 t80 -129.57 141.2 51.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.55 0.214 . . . . 0.0 110.872 -179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 1.104 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.1 tp10 -137.38 153.32 50.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.14 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.603 HG23 HD22 ' A' ' 39' ' ' LEU . 47.8 mt -111.9 124.77 68.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 173.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.1 t80 -109.69 100.92 9.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.204 0.526 . . . . 0.0 109.884 -177.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 94' ' ' CYS . 15.9 mm100 -83.33 125.97 32.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.263 -178.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.8 mt -111.71 111.1 34.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 43' ' ' THR . 53.5 p -92.62 115.03 27.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.98 0.419 . . . . 0.0 110.815 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.622 HD11 HD22 ' A' ' 114' ' ' LEU . 0.5 OUTLIER -109.21 29.05 7.88 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.099 0.476 . . . . 0.0 110.106 177.507 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.646 ' HA ' HG12 ' A' ' 44' ' ' VAL . 16.8 t70 -73.41 -77.67 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.572 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.17 -31.13 2.38 Favored Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.872 -178.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -81.61 135.97 35.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.165 0.507 . . . . 0.0 111.763 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -79.34 -52.14 8.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.963 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -66.71 -29.7 69.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -165.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . 0.402 ' CD2' ' HA ' ' A' ' 46' ' ' ASN . 17.6 t80 -88.63 -40.05 13.61 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.48 ' CZ2' ' HG ' ' A' ' 23' ' ' LEU . 28.5 t90 -57.51 -47.62 81.46 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.326 172.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.664 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 14.2 mtpp -65.66 -47.71 74.61 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -176.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.5 p -63.92 -38.52 91.38 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.318 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.445 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 16.8 m -78.71 -42.72 27.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.135 -177.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.876 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -88.53 -33.46 17.74 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -169.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 2.0 t0 -73.43 -12.19 60.72 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 110.017 -174.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -101.99 13.49 34.61 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.011 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 87' ' ' ALA . 53.6 mt -96.69 150.33 36.84 Favored Pre-proline 0 N--CA 1.447 -0.592 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.525 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.736 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.2 Cg_endo -74.02 -42.39 0.77 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.991 3.127 . . . . 0.0 113.125 -177.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.736 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.7 p90 -90.15 -167.43 1.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.37 -171.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.401 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 49.0 t -81.69 130.79 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.158 -174.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.727 ' HA ' ' HB2' ' A' ' 73' ' ' GLN . 53.1 m -133.52 102.13 5.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.889 0.376 . . . . 0.0 110.233 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.643 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.0 m -114.15 173.25 3.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.761 -175.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -124.34 136.19 53.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.785 0.326 . . . . 0.0 111.611 -177.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -72.35 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.396 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.32 -25.46 33.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.1 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -97.75 -12.33 22.39 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.861 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 61.78 66.07 2.85 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.616 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.53 ' HB2' HD12 ' A' ' 76' ' ' LEU . . . 77.81 -16.11 0.69 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.397 0.679 . . . . 0.0 111.749 177.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -92.05 19.47 6.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.208 0.528 . . . . 0.0 109.712 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.509 ' HB3' HG13 ' A' ' 106' ' ' ILE . 9.2 t -72.81 129.76 38.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.123 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 3.8 p -62.09 -30.88 71.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.458 -177.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.481 ' HA ' HD12 ' A' ' 108' ' ' LEU . 55.6 m-85 -61.55 -34.54 75.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.518 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.509 HG13 ' HB3' ' A' ' 103' ' ' SER . 65.6 mt -58.92 -39.28 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.0 0.429 . . . . 0.0 110.478 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.3 m -74.36 -29.06 61.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 177.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.481 HD12 ' HA ' ' A' ' 105' ' ' TYR . 94.9 mt -70.57 -25.35 63.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.209 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.457 ' HB3' ' CE2' ' A' ' 118' ' ' PHE . 68.4 m-85 -77.54 -12.81 60.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.23 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.424 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.15 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -171.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.696 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 2.4 tt . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.696 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 44.3 Cg_exo -51.22 144.04 8.78 Favored 'Cis proline' 0 C--N 1.362 1.261 0 CA-C-N 120.022 1.043 . . . . 0.0 114.079 2.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.9 t -139.05 175.33 9.65 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.799 -173.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.653 HG11 HD11 ' A' ' 136' ' ' LEU . 9.3 p -142.32 152.54 18.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.822 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.63 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 84.1 m-85 -137.81 161.31 36.91 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 1.007 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.5 tp -110.9 136.76 49.45 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.802 -174.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 2.9 t -137.85 122.95 24.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 172.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.593 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 10.3 p30 -87.57 176.07 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 119.963 -0.695 . . . . 0.0 109.728 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.516 HH12 ' HA ' ' A' ' 144' ' ' LEU . 22.9 ptt-85 -64.12 -9.79 18.69 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -165.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.54 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 66.4 t30 -88.36 7.32 33.09 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.452 -0.78 . . . . 0.0 109.518 174.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.516 ' O ' HG21 ' A' ' 15' ' ' ILE . 0.1 OUTLIER 74.83 24.45 1.6 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.914 -178.176 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.593 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 84.7 mt-10 -91.45 116.05 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.576 -172.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 126' ' ' LEU . 1.6 tm? -59.56 107.66 0.62 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.584 0.707 . . . . 0.0 109.228 174.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 1.007 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.4 m -80.99 -56.62 3.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.41 -173.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.25 18.82 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.63 ' HG3' ' CE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -104.26 167.49 9.72 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.963 178.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.09 51.17 Favored Glycine 0 CA--C 1.52 0.395 0 N-CA-C 114.546 0.579 . . . . 0.0 114.546 -174.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -21.7 46.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.286 0.543 . . . . 0.0 110.328 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.432 ' HB2' ' H ' ' A' ' 129' ' ' ARG . 0.9 OUTLIER -71.5 -36.17 71.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.693 173.772 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 119' ' ' LEU . 96.3 mt -69.53 129.86 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.831 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.99 95.61 5.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 11.3 t0 69.22 117.53 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 O-C-N 124.175 0.922 . . . . 0.0 111.185 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.653 HD11 HG11 ' A' ' 117' ' ' VAL . 14.9 mt -75.83 -25.76 56.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.443 -177.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.647 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.5 t70 -60.73 -41.1 94.65 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -70.8 -36.38 72.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.672 172.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.492 ' HB3' ' HA ' ' A' ' 136' ' ' LEU . . . -65.37 -53.35 44.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.921 0.391 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.757 HD12 HD12 ' A' ' 60' ' ' LEU . 55.6 mt -60.34 -40.91 85.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.145 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -58.35 -48.75 79.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -66.32 -20.04 65.98 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.961 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.714 HD21 ' HG ' ' A' ' 119' ' ' LEU . 66.7 mt -66.83 -39.85 87.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.413 0.625 . . . . 0.0 109.866 172.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.516 ' HA ' HH12 ' A' ' 122' ' ' ARG . 96.2 mt . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.737 177.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.676 HD11 HD13 ' A' ' 30' ' ' LEU . 15.3 tt . . . . . 0 N--CA 1.446 -0.653 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.566 ' O ' HD12 ' A' ' 30' ' ' LEU . 4.0 mp -87.65 112.66 23.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.3 108.56 4.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.175 0.512 . . . . 0.0 109.868 -177.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.404 HG12 ' CE1' ' A' ' 105' ' ' TYR . 8.5 mt -101.43 114.93 42.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.043 -178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.574 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 79.2 mt-30 -105.58 101.11 10.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.869 -178.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.5 mt -132.22 158.28 42.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.193 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 26' ' ' ASN . 54.1 mttm -88.73 145.59 25.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.884 0.373 . . . . 0.0 111.536 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.559 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 25.9 m-20 -69.06 -177.0 0.96 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.263 174.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.536 HD23 ' SG ' ' A' ' 94' ' ' CYS . 3.5 pp -61.7 -28.48 69.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.972 0.891 . . . . 0.0 109.14 168.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.586 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 9.2 mtpm? -79.0 -7.18 57.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.024 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' ' 21' ' ' LYS . . . 81.93 16.04 73.53 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.947 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.559 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 11.6 m-20 -80.91 108.45 14.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.46 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.2 m -68.48 107.56 2.95 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.613 175.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.507 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -100.76 131.21 46.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.145 -178.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.574 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 24.5 p -102.36 161.66 13.53 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 170.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.676 HD13 HD11 ' A' ' 15' ' ' ILE . 51.1 mt -80.29 -29.02 38.17 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.556 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 p -67.5 -8.34 32.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.392 175.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -90.29 -45.14 9.24 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.471 ' CD1' ' HG2' ' A' ' 70' ' ' GLU . 1.4 mm? -67.5 -11.87 58.98 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 113.89 -1.505 . . . . 0.0 111.364 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 124' ' ' ASN . 8.7 ttpp -57.26 101.74 0.07 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.024 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 162.81 -39.95 0.35 Allowed Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.806 -1.317 . . . . 0.0 109.806 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.678 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 98.9 mttt -100.95 174.01 6.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 171.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.565 HG13 ' HD1' ' A' ' 69' ' ' PHE . 3.4 p -83.43 118.64 31.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 167.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.22 124.58 55.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.289 -167.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.465 HD11 ' CD2' ' A' ' 136' ' ' LEU . 12.2 tp -93.04 107.58 19.34 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.205 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.606 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.8 mm -84.73 106.54 14.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.585 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 28.8 t0 -101.62 129.8 47.82 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.883 -177.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -120.97 97.93 5.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.022 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.414 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -148.95 164.8 33.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.013 0.435 . . . . 0.0 111.573 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 76' ' ' LEU . 5.1 m -97.3 144.77 10.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.872 178.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.688 ' H ' ' HB3' ' A' ' 77' ' ' ASP . 7.3 m-85 -105.98 78.44 1.32 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.602 0.715 . . . . 0.0 110.436 172.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -163.15 16.82 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -144.48 131.88 20.85 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.171 -158.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.02 72.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.061 -175.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.14 -24.76 68.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 0.0 110.973 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.3 m -74.76 -27.3 60.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.094 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.52 -38.3 68.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.153 0.501 . . . . 0.0 110.231 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.07 -25.89 61.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.527 0.679 . . . . 0.0 109.802 174.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.53 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.7 t60 -75.32 -47.55 27.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.197 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.658 ' HA ' HD12 ' A' ' 57' ' ' LEU . 33.7 p30 -73.76 -21.28 60.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.86 0.362 . . . . 0.0 110.889 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.31 -57.49 12.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.804 172.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.07 75.13 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.664 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -63.21 -41.25 99.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.935 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -63.25 -31.43 72.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.329 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -74.48 -55.11 6.32 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 122.789 1.281 . . . . 0.0 108.041 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.75 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.0 -30.89 60.46 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.565 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -76.93 -46.25 24.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -62.61 -22.13 66.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.802 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -77.98 -61.61 1.94 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.194 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.564 ' OH ' ' HE3' ' A' ' 141' ' ' LYS . 96.3 m-85 -108.57 -1.43 19.65 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -164.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -68.01 170.22 8.7 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.438 176.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.2 m 71.5 -38.43 0.42 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.119 0.567 . . . . 0.0 111.08 -174.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' A' ' 65' ' ' ALA . 61.1 mt-30 -71.01 -9.81 58.66 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.457 0.646 . . . . 0.0 110.514 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.425 ' O ' HG12 ' A' ' 37' ' ' VAL . . . 117.7 34.36 1.18 Allowed Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.201 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.565 ' HD1' HG13 ' A' ' 37' ' ' VAL . 82.0 t80 -112.36 142.11 45.28 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 177.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.678 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.2 tp10 -143.17 155.34 44.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 178.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.504 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 54.7 mt -123.11 126.16 73.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.176 0.513 . . . . 0.0 109.993 175.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.553 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 78.6 t80 -112.08 100.87 9.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 31.2 tt0 -98.28 129.21 44.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.679 -175.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.408 HD11 ' HE2' ' A' ' 72' ' ' TYR . 57.2 mt -109.31 120.1 59.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.847 175.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 89.7 p -89.48 125.81 35.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.48 0.657 . . . . 0.0 110.336 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.423 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 14.3 mt -102.46 32.81 3.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 175.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.688 ' HB3' ' H ' ' A' ' 45' ' ' TYR . 4.6 p-10 -73.03 177.98 4.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.393 -168.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.89 26.03 4.57 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.011 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -162.89 109.36 1.19 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.466 ' HB2' HH12 ' A' ' 96' ' ' ARG . 35.1 tt0 -58.84 -40.97 85.8 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.706 -176.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -48.6 80.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.628 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -63.28 -47.85 80.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.859 0.362 . . . . 0.0 110.251 -175.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.414 ' HB2' ' HB2' ' A' ' 45' ' ' TYR . 21.5 t90 -61.1 -52.28 65.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.462 175.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.499 ' HD2' ' HB2' ' A' ' 23' ' ' LEU . 26.3 tptp -52.57 -60.26 3.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.188 -177.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.8 m -60.06 -31.53 70.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.98 -173.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.0 t -85.32 -30.71 23.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 0.0 111.533 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.564 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.9 -18.76 26.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.328 0.585 . . . . 0.0 110.617 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.405 ' OD2' ' HG3' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -65.23 -8.14 16.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.414 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -116.37 16.34 15.72 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.497 0.665 . . . . 0.0 110.206 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.564 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 37.1 mt -87.04 141.28 33.02 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 121.495 0.664 . . . . 0.0 111.575 -178.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.712 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 68.7 Cg_endo -80.22 -30.13 2.23 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 123.919 3.079 . . . . 0.0 112.956 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.712 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.2 p90 -102.16 -169.28 1.65 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.258 -172.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.553 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 44.9 t -77.79 133.17 31.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.882 -176.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.536 ' SG ' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -140.63 95.48 2.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.431 0.634 . . . . 0.0 110.399 -176.12 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.487 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 18.0 m -113.79 170.27 4.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.158 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.466 HH12 ' HB2' ' A' ' 80' ' ' GLU . 38.0 ttp180 -126.19 138.31 53.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.599 0.238 . . . . 0.0 111.039 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -81.1 157.59 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.027 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.406 ' C ' HD22 ' A' ' 99' ' ' ASN . . . -81.56 -23.3 37.27 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -175.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.406 HD22 ' C ' ' A' ' 98' ' ' ALA . 0.8 OUTLIER -122.59 -11.71 8.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.646 0.26 . . . . 0.0 111.642 -178.258 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 71.23 -121.1 8.85 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.606 -0.806 . . . . 0.0 111.853 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.26 -14.93 62.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.984 0.421 . . . . 0.0 110.928 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -95.88 12.25 30.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.566 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.488 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.2 t -65.97 141.59 58.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.78 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.8 m -69.82 -24.03 63.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.202 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.404 ' CE1' HG12 ' A' ' 18' ' ' ILE . 63.7 m-85 -59.56 -47.66 84.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.488 HG13 ' HB3' ' A' ' 103' ' ' SER . 32.5 mt -57.99 -36.67 57.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.281 -176.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.8 m -68.93 -27.22 65.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.283 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.5 -27.15 64.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.753 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -87.17 1.53 52.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.64 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.975 0 C-N-CA 123.74 0.816 . . . . 0.0 111.182 -177.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 27.7 mt . . . . . 0 C--O 1.233 0.21 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 63.1 Cg_endo -71.7 156.09 97.46 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.853 -1.311 . . . . 0.0 113.017 0.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.48 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 5.9 m -146.16 173.74 11.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.263 -177.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.406 HG11 HD21 ' A' ' 136' ' ' LEU . 2.4 p -129.59 161.33 39.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.034 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.606 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.5 m-85 -137.6 157.78 45.78 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 174.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.891 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 6.8 tp -110.96 139.35 46.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -175.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.0 t -135.62 121.02 29.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.552 0.215 . . . . 0.0 110.964 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -76.39 164.15 26.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 34.1 mtt180 -52.3 -18.59 1.64 Allowed 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.155 0.91 . . . . 0.0 113.319 -169.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -84.74 6.25 25.08 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.505 ' HB2' ' HB2' ' A' ' 34' ' ' LYS . 1.6 t-20 63.0 52.23 2.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.538 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 49.5 mt-10 -127.22 143.57 51.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.422 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.0 tt -68.85 109.81 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.306 0.574 . . . . 0.0 110.176 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.891 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 58.1 m -76.82 -53.96 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.291 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -162.54 153.83 17.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 -177.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.587 ' O ' HG13 ' A' ' 133' ' ' ILE . 91.7 mtt180 -89.28 156.81 18.5 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.328 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.16 -26.14 60.9 Favored Glycine 0 C--O 1.225 -0.463 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -71.64 -11.78 61.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.443 0.639 . . . . 0.0 110.393 177.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -115.67 -37.22 4.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.069 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.77 HG21 ' HG ' ' A' ' 136' ' ' LEU . 42.7 mt -68.65 145.97 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -128.94 -43.02 1.36 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -130.78 111.92 12.58 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.552 173.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.77 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.8 mp -77.67 -30.48 52.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.963 -178.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -48.38 -57.83 5.49 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.609 0.568 . . . . 0.0 110.529 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.625 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 37.5 mm-40 -58.84 -43.02 90.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.935 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.506 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -60.76 -43.14 98.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.341 -175.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.75 HD12 HD12 ' A' ' 60' ' ' LEU . 40.7 mt -57.89 -44.43 86.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.717 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 138' ' ' GLU . 22.7 mttt -51.1 -55.42 17.78 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.447 0.642 . . . . 0.0 111.234 176.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.625 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 2.6 ptpt -74.2 -18.07 60.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.228 -0.897 . . . . 0.0 112.353 -173.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -83.71 -40.06 19.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.64 0.257 . . . . 0.0 111.245 173.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 71.8 mt . . . . . 0 CA--C 1.52 -0.202 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.8 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.644 HG21 ' O ' ' A' ' 124' ' ' ASN . 7.7 pt . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.465 ' O ' HD12 ' A' ' 30' ' ' LEU . 89.0 mt -108.55 113.86 45.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 173.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -98.5 108.55 21.27 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 mt -94.4 121.43 45.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.714 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.573 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 32.3 mt-30 -119.04 100.77 7.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.49 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.1 mt -135.3 154.46 51.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 93.0 mttt -79.16 141.62 37.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.159 0.504 . . . . 0.0 110.894 -176.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.63 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 4.0 p-10 -88.45 -169.02 2.39 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.902 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.443 HD13 ' HB3' ' A' ' 87' ' ' ALA . 49.3 tp -52.99 -37.83 61.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.702 177.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.432 ' HB2' HD22 ' A' ' 26' ' ' ASN . 38.7 mttp -71.2 -27.79 63.75 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -177.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.26 18.52 14.61 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.504 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.432 HD22 ' HB2' ' A' ' 24' ' ' LYS . 50.5 m-80 -108.27 127.9 54.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 178.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.609 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.7 m -63.12 110.6 1.89 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.383 0.611 . . . . 0.0 110.856 178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.573 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 21.3 mmm180 -86.15 134.85 33.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.967 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.1 p -118.5 155.91 30.0 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 173.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.594 HD22 HG11 ' A' ' 38' ' ' VAL . 71.9 mt -73.29 -23.14 60.26 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 p -71.82 -0.92 12.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.72 175.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -98.11 -47.11 5.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.954 0.407 . . . . 0.0 110.882 178.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' A' ' 38' ' ' VAL . 0.6 OUTLIER -91.9 24.72 3.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.71 0.767 . . . . 0.0 109.41 175.334 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.605 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 59.4 tttp -55.92 -42.95 76.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.983 -1.462 . . . . 0.0 112.524 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.16 3.45 38.49 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 115.786 -0.643 . . . . 0.0 113.478 -176.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 6.6 mppt? -125.47 168.81 13.1 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.761 HG21 HD23 ' A' ' 144' ' ' LEU . 45.5 t -73.19 124.91 31.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' A' ' 33' ' ' LEU . 46.7 t -109.01 124.39 65.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.387 0.613 . . . . 0.0 111.462 -169.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.457 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.2 tp -97.35 133.61 41.72 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 171.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.592 HG13 ' HB2' ' A' ' 118' ' ' PHE . 1.1 pt -118.1 106.9 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.185 0.517 . . . . 0.0 110.873 175.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.474 ' HB2' ' HA ' ' A' ' 73' ' ' GLN . 13.8 m-20 -98.22 133.28 42.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.858 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -117.33 97.32 5.84 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.459 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 11.1 t -143.7 179.27 7.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 -175.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.668 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -126.02 124.29 65.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 120.725 0.298 . . . . 0.0 110.325 -178.879 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.71 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 28.8 m-85 -74.98 79.43 2.18 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.235 0.54 . . . . 0.0 110.006 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 41.3 t30 172.95 -32.33 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.366 -1.288 . . . . 0.0 108.661 174.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.668 ' HB2' HG13 ' A' ' 44' ' ' VAL . 37.4 t-20 -65.1 133.89 52.6 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.852 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -30.8 69.28 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.529 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 90.0 mtp -67.94 -22.54 65.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.347 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -71.14 -23.33 62.05 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.288 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.81 18.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.848 0.356 . . . . 0.0 110.718 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.04 -39.31 93.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.69 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.482 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.3 t60 -62.85 -45.12 94.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.991 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.659 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.3 m-20 -74.7 -22.17 58.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.782 -176.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.471 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -68.58 -43.57 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.36 -38.88 81.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.737 174.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 54' ' ' ASN . 86.7 mt -62.51 -42.29 99.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.001 177.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.471 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.4 tpm_? -54.84 -36.03 64.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.777 176.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -79.97 -50.29 10.63 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -173.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.854 HD12 HD12 ' A' ' 140' ' ' ILE . 2.7 mm? -55.77 -30.72 61.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 113.271 -1.786 . . . . 0.0 111.429 178.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -72.72 -48.38 39.24 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.231 0.539 . . . . 0.0 109.685 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -63.38 -21.18 66.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.643 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.564 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 33.5 mttm -82.21 -61.32 1.93 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.925 -178.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.498 ' HB3' HD11 ' A' ' 144' ' ' LEU . 83.8 m-85 -113.35 -5.85 13.55 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -164.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.592 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.15 -34.9 75.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.248 0.476 . . . . 0.0 111.585 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 m -63.17 -22.07 66.62 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.775 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -98.57 18.59 16.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.701 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.04 54.43 1.62 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.344 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.592 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 54.0 t80 -132.29 125.9 32.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.71 0.29 . . . . 0.0 110.274 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.461 ' HB3' HD12 ' A' ' 33' ' ' LEU . 28.9 tt0 -125.36 154.73 41.4 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.583 ' HB ' ' CB ' ' A' ' 92' ' ' TRP . 49.8 mt -118.8 126.32 75.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.06 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.497 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 75.7 t80 -112.78 100.12 8.43 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.275 -0.875 . . . . 0.0 108.859 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.474 ' HA ' ' HB2' ' A' ' 41' ' ' ASP . 6.1 tt0 -102.48 126.32 49.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.348 -175.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 54.9 mt -103.56 129.09 56.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.339 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.71 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 3.8 p -95.85 131.63 41.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.487 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 22.2 mt -116.45 33.67 5.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.24 0.543 . . . . 0.0 109.741 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.5 ' OD2' ' HB2' ' A' ' 75' ' ' SER . 3.5 p30 -85.29 -165.91 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.752 -175.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -135.5 30.16 2.81 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.779 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -151.36 101.93 2.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.993 0.425 . . . . 0.0 110.632 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -64.98 -31.76 73.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.653 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -46.0 90.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.564 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -71.97 -42.02 67.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.834 0.349 . . . . 0.0 110.6 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 36.9 t90 -60.77 -48.38 82.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.747 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.465 ' HB2' ' HE3' ' A' ' 84' ' ' LYS . 37.2 ttmt -62.18 -42.14 98.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.806 -175.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 7.9 p -71.22 -40.15 71.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.831 0.348 . . . . 0.0 111.264 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.53 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 25.3 t -69.9 -45.62 67.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.713 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.443 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -66.95 -26.32 66.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.622 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.404 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 27.7 t70 -61.85 -31.34 71.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.763 0.315 . . . . 0.0 111.071 -178.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -102.64 7.86 39.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.935 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 86' ' ' SER . 40.0 mt -94.74 140.62 22.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.233 0.54 . . . . 0.0 111.339 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.62 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.2 Cg_endo -72.45 -49.3 0.28 Allowed 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 123.875 3.05 . . . . 0.0 113.938 -174.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.62 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.1 p90 -81.88 -172.31 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.984 0.421 . . . . 0.0 111.933 -173.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.439 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 90.6 t -85.8 117.52 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.357 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 34.1 m -113.68 108.8 17.61 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.911 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.63 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 23.2 m -114.77 172.1 4.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.934 -179.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -133.04 140.37 47.68 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.085 -177.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -93.03 151.0 20.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.06 -18.52 42.84 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -115.82 -12.17 11.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.812 0.339 . . . . 0.0 111.033 -175.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.487 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 66.41 -121.29 17.43 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.074 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.62 -6.81 43.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.765 0.316 . . . . 0.0 111.303 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -100.97 15.8 27.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.428 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.442 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.6 t -63.6 132.68 51.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.172 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.5 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 16.5 m -59.38 -28.95 67.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.172 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -60.79 -45.42 94.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.735 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.442 HG13 ' HB3' ' A' ' 103' ' ' SER . 43.2 mt -58.0 -36.2 55.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.113 0.482 . . . . 0.0 110.433 -177.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -72.67 -39.66 66.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.535 177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.7 mt -64.26 -32.12 73.58 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.573 -178.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -69.99 -27.3 64.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.947 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.46 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 -164.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 115' ' ' PRO . 0.3 OUTLIER . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.613 ' HA ' HD23 ' A' ' 114' ' ' LEU . 33.6 Cg_endo -63.83 139.97 36.87 Favored 'Cis proline' 0 C--N 1.354 0.858 0 C-N-CA 124.371 -1.096 . . . . 0.0 113.433 1.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.11 177.6 7.33 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.98 -177.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 7.9 p -138.05 159.25 33.09 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.647 ' HE2' ' HD2' ' A' ' 129' ' ' ARG . 86.2 m-85 -138.04 163.27 32.02 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 1.025 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.4 tp -110.98 135.03 52.1 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.745 -174.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 49.1 t -131.18 117.53 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.32 0.581 . . . . 0.0 110.301 172.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.463 ' HA ' HD13 ' A' ' 143' ' ' LEU . 31.4 t30 -70.84 161.15 31.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 122' ' ' ARG . 17.0 ptt180 -73.88 29.68 0.08 Allowed 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -170.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.541 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 4.4 t-20 -120.37 2.97 10.83 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 169.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.644 ' O ' HG21 ' A' ' 15' ' ' ILE . 0.2 OUTLIER 69.28 62.78 0.29 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.709 -167.016 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.541 ' HG3' ' HB3' ' A' ' 123' ' ' ASN . 38.3 mt-10 -122.2 123.81 42.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.019 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 tt -62.04 106.8 0.76 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 171.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 1.025 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 47.0 m -83.08 -54.7 4.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.972 -172.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -167.66 172.13 9.58 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.755 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.647 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 19.6 mmt85 -78.62 175.39 10.43 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -80.63 -26.62 53.65 Favored Glycine 0 C--N 1.315 -0.585 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.616 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.459 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 mp0 -75.47 -41.85 54.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.164 0.507 . . . . 0.0 112.021 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.611 HD22 ' N ' ' A' ' 133' ' ' ILE . 0.2 OUTLIER -81.03 -6.58 58.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.704 -176.332 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.645 HG21 ' HG ' ' A' ' 136' ' ' LEU . 63.3 mt -85.61 110.26 19.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.313 0.578 . . . . 0.0 109.975 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -61.01 -25.36 66.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.026 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 137' ' ' ASP . 36.2 t70 -173.05 116.48 0.28 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.645 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.4 mp -75.17 -28.52 60.11 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.924 -0.311 . . . . 0.0 111.043 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.471 ' HB3' ' OD2' ' A' ' 135' ' ' ASP . 9.3 t70 -53.51 -54.93 30.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 173.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.22 -48.55 68.07 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.666 172.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.509 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -64.24 -52.12 60.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.373 -172.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.854 HD12 HD12 ' A' ' 60' ' ' LEU . 37.6 mt -61.3 -36.83 75.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.275 0.56 . . . . 0.0 110.295 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 17.2 ttpt -60.11 -40.0 88.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.149 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 139' ' ' ALA . 17.1 ptpt -85.02 -19.73 31.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.244 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.515 HD11 ' HG ' ' A' ' 119' ' ' LEU . 16.0 mt -75.15 -32.83 61.43 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.682 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.761 HD23 HG21 ' A' ' 37' ' ' VAL . 34.0 mt . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.518 178.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.3 tp . . . . . 0 N--CA 1.448 -0.558 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.454 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.1 mp -98.9 104.56 16.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.11 110.9 2.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.288 0.566 . . . . 0.0 110.093 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.465 HG21 ' CD1' ' A' ' 74' ' ' ILE . 25.1 mm -90.4 108.6 19.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.259 -178.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.626 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 19.4 mt-30 -105.31 99.8 9.4 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.192 0.52 . . . . 0.0 110.795 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.2 mt -138.35 159.0 43.19 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.647 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 46.0 mtmt -89.69 138.18 31.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.737 0.779 . . . . 0.0 111.395 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.636 ' OD1' ' HG ' ' A' ' 23' ' ' LEU . 9.9 t70 -71.09 169.04 15.85 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.819 -1.537 . . . . 0.0 109.821 176.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.848 HD13 ' HA ' ' A' ' 88' ' ' ASP . 2.5 pp -51.82 -34.68 41.34 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.695 0.759 . . . . 0.0 111.212 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -69.34 -6.91 32.76 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.115 177.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.53 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 89.74 7.91 68.18 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.308 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -101.69 118.29 36.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.553 0.216 . . . . 0.0 111.487 -175.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.647 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 24.3 m -58.28 124.01 18.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.223 0.535 . . . . 0.0 110.839 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.626 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.3 mmm180 -107.03 142.98 35.8 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.563 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.5 p -120.17 162.34 19.51 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.681 ' HB3' HD21 ' A' ' 124' ' ' ASN . 49.9 mt -80.1 -29.65 39.07 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.3 p -59.33 -22.89 61.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.701 173.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -85.5 -52.56 5.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.153 176.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -13.98 11.52 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.221 -178.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.613 ' NZ ' ' HB3' ' A' ' 34' ' ' LYS . 3.6 ttpm? -53.48 -14.98 0.91 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.224 1.01 . . . . 0.0 112.475 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.53 ' C ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.1 -16.37 59.8 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.651 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.53 ' HD2' ' C ' ' A' ' 35' ' ' GLY . 2.9 mptp? -136.14 -178.9 5.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 110.397 176.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.719 HG21 HD23 ' A' ' 144' ' ' LEU . 56.3 t -78.58 123.29 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 172.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.1 t -103.32 122.27 55.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.308 0.575 . . . . 0.0 112.204 -163.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.785 HD11 HD21 ' A' ' 136' ' ' LEU . 13.0 tp -92.06 122.13 34.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.739 171.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.534 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.0 mm -98.98 106.03 18.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.714 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 25.6 t70 -108.4 131.07 55.14 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.869 -178.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.511 ' HD2' HD11 ' A' ' 76' ' ' LEU . 32.7 m-85 -119.63 97.77 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.106 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.583 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.2 t -137.39 164.87 27.58 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.996 0.427 . . . . 0.0 111.233 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.597 HG23 ' HB2' ' A' ' 47' ' ' ASN . 3.4 m -102.49 116.75 46.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.051 0.453 . . . . 0.0 110.437 177.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' A' ' 83' ' ' TRP . 7.4 m-85 -74.89 84.13 2.2 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.699 0.761 . . . . 0.0 109.057 175.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 177.69 -37.81 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.149 -165.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.597 ' HB2' HG23 ' A' ' 44' ' ' VAL . 10.1 t-20 -89.76 146.56 24.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.383 -169.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.31 -30.77 71.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.724 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.3 mmm -64.27 -27.19 68.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.793 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.9 m -69.33 -28.25 66.07 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.164 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.72 -55.7 15.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.866 0.365 . . . . 0.0 110.67 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.03 77.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.623 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.495 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 67.8 t60 -66.13 -38.25 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.454 178.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.447 ' HA ' HD12 ' A' ' 57' ' ' LEU . 23.4 t-20 -66.95 -39.45 87.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.455 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -57.34 -50.23 73.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.501 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.03 83.8 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.005 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.4 mt -62.97 -42.38 99.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 109.943 175.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -61.68 -28.83 69.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.023 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -72.28 -53.25 13.02 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.708 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -56.56 -32.1 64.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 112.345 -2.207 . . . . 0.0 111.072 176.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -73.1 -47.66 42.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.119 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -61.93 -22.46 65.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.263 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -79.7 -55.83 4.72 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.666 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.611 ' HB3' HD11 ' A' ' 144' ' ' LEU . 93.6 m-85 -118.09 -11.4 10.18 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -165.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.528 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -56.33 -42.87 78.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -174.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.3 p -54.2 -43.48 70.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.414 -176.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -69.69 -33.21 72.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 151.81 47.74 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.303 -0.951 . . . . 0.0 112.582 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.644 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 66.9 t80 -127.92 138.77 52.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.359 -0.238 . . . . 0.0 110.359 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.36 155.56 49.25 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.454 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 46.3 mt -116.84 114.97 47.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.446 0.641 . . . . 0.0 110.503 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 87.7 t80 -100.48 101.3 12.21 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.606 178.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.714 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 10.7 mt-30 -94.86 143.18 26.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.031 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.465 ' CD1' HG21 ' A' ' 18' ' ' ILE . 57.3 mt -127.21 124.88 65.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.715 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.627 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 10.7 p -92.49 129.91 38.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.947 0.403 . . . . 0.0 111.116 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.511 HD11 ' HD2' ' A' ' 42' ' ' PHE . 25.1 mt -112.45 10.5 19.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.88 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.627 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 3.9 p-10 -69.22 -49.99 51.32 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.322 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.94 -34.54 3.24 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.632 176.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -87.04 136.36 32.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.934 0.874 . . . . 0.0 111.367 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 44.1 tt0 -78.7 -29.0 45.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.7 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -79.59 -50.6 10.45 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.286 -167.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -65.44 -39.31 91.9 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.498 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 16.0 t90 -61.99 -47.93 82.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.792 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.698 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 46.2 tttm -68.34 -49.72 58.33 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.968 -176.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.6 p -58.93 -30.31 67.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.202 0.525 . . . . 0.0 111.423 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.1 m -82.84 -46.22 13.32 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.684 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.512 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.24 -18.8 27.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -171.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.848 ' HA ' HD13 ' A' ' 23' ' ' LEU . 3.6 t70 -55.36 -33.56 63.52 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.93 0.492 . . . . 0.0 111.981 -170.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -104.26 11.72 34.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.145 -176.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.512 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 23.3 mt -81.83 157.7 68.86 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 121.121 0.486 . . . . 0.0 111.712 -176.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.624 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 72.1 Cg_endo -69.8 -44.41 2.07 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.744 2.963 . . . . 0.0 114.208 -176.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.624 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -100.75 -170.69 1.89 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 112.005 -171.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.559 HG11 ' HG3' ' A' ' 28' ' ' ARG . 90.3 t -83.79 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.775 -176.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 84.0 m -136.17 108.81 7.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.07 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.428 HG12 ' CA ' ' A' ' 22' ' ' ASP . 14.6 m -113.89 159.8 13.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.009 -177.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 80' ' ' GLU . 12.2 ttp180 -117.73 134.42 54.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.379 -177.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -92.69 143.56 26.18 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.35 -14.09 55.84 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -99.95 -13.31 19.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.744 -172.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.41 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . 64.62 -98.45 0.28 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.747 178.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -105.92 1.49 26.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.956 0.408 . . . . 0.0 110.891 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -104.56 9.47 35.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.119 0.485 . . . . 0.0 110.193 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.534 ' HB2' HG13 ' A' ' 106' ' ' ILE . 4.2 m -65.27 122.21 16.59 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.554 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.543 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.3 m -55.17 -27.1 43.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.867 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -55.59 -47.24 76.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.613 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.534 HG13 ' HB2' ' A' ' 103' ' ' SER . 53.1 mt -57.07 -34.77 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.765 -176.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.9 m -77.17 -37.27 54.11 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 177.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 104' ' ' SER . 96.7 mt -63.58 -37.65 88.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.599 -178.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -71.53 -24.41 61.94 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.412 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 . . . . . 0 C--N 1.331 -0.202 0 CA-C-O 122.1 0.953 . . . . 0.0 108.758 -165.398 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.469 HD13 ' OG ' ' A' ' 116' ' ' SER . 3.7 mm? . . . . . 0 N--CA 1.465 0.28 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.97 143.02 74.8 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 123.86 -1.308 . . . . 0.0 112.919 0.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.469 ' OG ' HD13 ' A' ' 114' ' ' LEU . 13.3 m -121.04 169.99 9.96 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.464 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.8 p -142.25 156.71 19.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.534 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.7 m-85 -140.23 160.16 40.57 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.921 HD13 HD11 ' A' ' 136' ' ' LEU . 13.9 tp -111.0 134.93 52.21 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -174.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.49 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.6 t -135.51 120.44 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.775 0.321 . . . . 0.0 110.554 177.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.641 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.1 p30 -77.74 167.56 21.36 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 4.68 0.78 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -168.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -95.65 5.3 51.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.681 HD21 ' HB3' ' A' ' 30' ' ' LEU . 1.7 t-20 64.42 48.05 2.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.277 -172.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.641 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 42.4 mt-10 -119.12 136.85 53.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.615 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.86 118.05 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.324 0.583 . . . . 0.0 110.801 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.619 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 18.4 m -87.31 -53.45 4.83 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.877 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.09 169.14 14.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.172 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.47 ' O ' HG13 ' A' ' 133' ' ' ILE . 93.4 mtt180 -91.7 168.33 11.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.885 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -65.16 -36.55 93.03 Favored Glycine 0 CA--C 1.509 -0.316 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.463 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 pm0 -75.93 -0.14 20.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.086 0.469 . . . . 0.0 111.125 177.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -110.07 -19.47 13.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.167 0.508 . . . . 0.0 110.05 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.535 HD11 ' HB2' ' A' ' 119' ' ' LEU . 97.2 mt -82.9 108.3 15.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.73 -177.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.78 ' HD2' ' H ' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -82.99 -26.34 31.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.955 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -161.36 110.43 1.58 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.921 HD11 HD13 ' A' ' 119' ' ' LEU . 2.8 tp -76.78 -33.17 58.05 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.754 -175.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.456 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.1 t70 -51.54 -52.83 43.81 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.48 177.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.543 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 28.7 mm-40 -56.57 -52.22 65.64 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.64 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.468 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.97 -50.6 71.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.183 -172.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.708 HD12 HD12 ' A' ' 60' ' ' LEU . 52.2 mt -59.55 -40.54 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.213 0.53 . . . . 0.0 110.249 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.428 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 29.4 ttpt -56.78 -47.59 79.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.016 178.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.543 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 11.5 ptpt -81.54 -18.88 43.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.76 -176.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 40.2 mt -71.91 -39.59 69.42 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 110.401 173.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.719 HD23 HG21 ' A' ' 37' ' ' VAL . 66.6 mt . . . . . 0 N--CA 1.453 -0.306 0 CA-C-O 121.504 0.669 . . . . 0.0 109.938 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.4 tp . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 120.982 0.42 . . . . 0.0 110.718 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.528 ' O ' HD12 ' A' ' 30' ' ' LEU . 4.2 mp -101.69 126.23 55.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -80.03 108.02 13.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.491 HD11 ' OH ' ' A' ' 109' ' ' TYR . 11.1 mt -96.07 125.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.729 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.612 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 28.9 mt-30 -118.73 99.96 7.11 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.985 0.421 . . . . 0.0 110.365 -178.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.7 mt -133.63 156.46 47.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 95.4 mttt -87.64 139.63 30.34 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.053 0.454 . . . . 0.0 111.308 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.584 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 7.8 p30 -87.82 -167.22 1.81 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.892 -176.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.578 HD13 ' HB3' ' A' ' 87' ' ' ALA . 55.3 tp -50.02 -36.15 27.63 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.272 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.618 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 8.9 mtmp? -84.87 -5.53 59.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.497 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.88 17.48 63.27 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -176.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.478 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.9 OUTLIER -97.08 117.26 30.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.209 -0.496 . . . . 0.0 110.275 -177.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.589 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 54.7 m -61.74 118.94 7.8 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.153 0.501 . . . . 0.0 111.269 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.612 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.9 mmm180 -101.38 139.17 37.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.498 176.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 36.8 p -118.06 161.89 19.09 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 172.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 16' ' ' ILE . 58.0 mt -79.88 -21.29 44.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.642 0.734 . . . . 0.0 109.863 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.35 -8.21 52.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.625 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -89.94 -60.51 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.994 0.426 . . . . 0.0 110.512 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.41 ' CD2' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -77.96 9.18 3.81 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 121.782 0.801 . . . . 0.0 111.066 -177.265 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.497 ' NZ ' ' HB3' ' A' ' 124' ' ' ASN . 24.1 ttmm -54.75 141.45 32.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.477 171.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.64 -25.53 8.5 Favored Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 -173.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.499 ' NZ ' ' HB2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -120.96 170.62 9.33 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.287 173.346 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.675 HG13 ' HG2' ' A' ' 122' ' ' ARG . 1.6 m -79.95 134.71 26.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.481 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 41.3 t -117.02 130.98 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-O 121.184 0.516 . . . . 0.0 111.155 -170.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.54 ' HB3' HG23 ' A' ' 71' ' ' ILE . 11.8 tp -94.96 107.52 19.56 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.649 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.687 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.8 mm -85.6 105.49 14.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.438 ' CG ' ' HE2' ' A' ' 53' ' ' HIS . 1.8 t70 -107.18 131.6 53.97 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.287 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -116.03 97.32 6.01 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.734 ' O ' ' HA ' ' A' ' 75' ' ' SER . 22.7 m -144.63 147.32 32.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.182 0.515 . . . . 0.0 111.161 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.556 HG13 ' HB2' ' A' ' 47' ' ' ASN . 1.6 p -95.46 123.01 47.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 122.236 -0.29 . . . . 0.0 110.946 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.691 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 30.5 m-85 -82.69 79.07 9.2 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.01 0.91 . . . . 0.0 109.659 175.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.424 ' HB3' HG22 ' A' ' 44' ' ' VAL . 7.3 t-20 -178.13 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 113.569 -1.65 . . . . 0.0 109.078 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.556 ' HB2' HG13 ' A' ' 44' ' ' VAL . 30.0 t-20 -71.85 142.86 49.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.558 -178.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.07 -30.12 69.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.822 -175.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 21.8 ptp -71.45 -17.06 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.0 0.429 . . . . 0.0 111.088 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.2 m -71.17 -30.58 66.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.517 -177.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.61 -47.31 86.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.878 0.371 . . . . 0.0 111.137 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.133 0.492 . . . . 0.0 110.646 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.483 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.5 t60 -68.12 -40.89 82.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.625 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.539 ' HA ' HD12 ' A' ' 57' ' ' LEU . 92.5 m-20 -63.65 -34.01 76.91 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.792 0.33 . . . . 0.0 111.05 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.11 -53.75 54.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.415 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.54 -35.59 76.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.06 -178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.539 HD12 ' HA ' ' A' ' 54' ' ' ASN . 86.8 mt -64.17 -41.55 97.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.515 0.674 . . . . 0.0 109.69 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 58' ' ' ARG . 28.5 tpt85 -64.56 -27.34 68.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.094 -178.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.474 ' OE2' ' HE3' ' A' ' 63' ' ' LYS . 3.7 tm-20 -75.54 -56.16 4.97 Favored 'General case' 0 CA--C 1.489 -1.385 0 CA-C-O 123.003 1.382 . . . . 0.0 107.801 -174.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.546 HD12 HD12 ' A' ' 140' ' ' ILE . 3.0 mm? -55.02 -29.33 57.15 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 111.819 -2.446 . . . . 0.0 111.067 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -66.86 -49.17 66.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.24 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.34 -26.38 66.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.713 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.474 ' HE3' ' OE2' ' A' ' 59' ' ' GLU . 74.2 mttt -77.02 -61.48 1.97 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.685 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -109.54 -11.84 14.75 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -164.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.587 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.53 -37.9 82.69 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.189 0.45 . . . . 0.0 111.494 -177.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.4 m -65.11 -13.87 59.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.839 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -101.39 6.64 42.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.087 0.47 . . . . 0.0 110.955 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.51 54.24 0.89 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.175 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.594 ' HD1' HG23 ' A' ' 37' ' ' VAL . 37.2 t80 -130.57 131.66 45.13 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 178.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -130.69 156.15 45.4 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.601 HD12 ' CE3' ' A' ' 92' ' ' TRP . 43.6 mt -122.34 129.13 75.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-O 120.995 0.426 . . . . 0.0 110.152 -175.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.484 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 89.8 t80 -113.27 100.4 8.54 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.237 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.79 140.99 29.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.819 -177.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.46 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 59.9 mt -127.16 107.8 17.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.606 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.734 ' HA ' ' O ' ' A' ' 43' ' ' THR . 0.0 OUTLIER -77.77 129.44 35.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.998 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.462 ' H ' ' HA ' ' A' ' 44' ' ' VAL . 48.2 mt -110.34 38.75 2.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.553 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.1 p30 -100.72 -178.77 3.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.449 -175.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 -25.64 4.8 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.481 173.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.607 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 30.4 t70 -103.14 97.47 7.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.997 0.427 . . . . 0.0 110.689 -177.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.662 ' HB3' ' CZ ' ' A' ' 96' ' ' ARG . 10.0 pt-20 -74.79 -13.99 60.65 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.622 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . 0.607 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.2 OUTLIER -52.07 -50.59 61.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.403 173.367 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -70.81 -39.68 72.94 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.165 0.507 . . . . 0.0 110.553 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.616 ' HE3' ' HB2' ' A' ' 80' ' ' GLU . 31.4 t90 -60.27 -46.58 89.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.077 176.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -64.43 -43.73 93.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.281 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.7 p -69.45 -39.06 77.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.5 t -72.87 -37.41 67.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.599 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.611 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -70.17 -23.09 62.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.091 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.03 -27.08 68.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.708 0.766 . . . . 0.0 110.329 174.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -102.46 12.52 36.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.995 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.499 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 24.8 mt -97.98 147.35 32.95 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 121.408 0.623 . . . . 0.0 112.215 -177.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.765 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 14.8 Cg_endo -100.21 3.33 0.8 Allowed 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 124.495 3.463 . . . . 0.0 114.168 -176.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.765 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 2.4 p90 -136.72 -170.09 2.61 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.219 -0.301 . . . . 0.0 111.047 -174.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.486 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 78.7 t -80.89 127.02 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.945 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.611 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 1.6 p -129.63 103.38 6.82 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.209 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.584 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 6.4 m -114.73 156.24 15.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.662 ' CZ ' ' HB3' ' A' ' 80' ' ' GLU . 12.6 ttp180 -120.91 139.06 53.75 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.347 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -89.24 148.54 23.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.59 -16.4 51.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 0.0 111.697 -176.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -107.34 -12.15 15.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.17 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.43 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 62.31 -120.69 22.86 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.014 -177.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.48 -5.73 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.356 . . . . 0.0 111.476 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -99.6 12.87 35.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.525 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.419 ' HB3' HG13 ' A' ' 106' ' ' ILE . 42.9 t -64.9 133.53 52.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.798 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.2 m -63.31 -25.1 68.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.796 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -60.63 -44.15 96.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.353 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.419 HG13 ' HB3' ' A' ' 103' ' ' SER . 65.3 mt -56.73 -41.3 74.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.989 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.5 m -66.12 -27.81 68.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.965 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -73.9 -18.27 60.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.04 -179.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.491 ' OH ' HD11 ' A' ' 18' ' ' ILE . 87.8 m-85 -98.27 0.73 46.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.45 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.769 0 O-C-N 123.972 0.795 . . . . 0.0 110.501 -177.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.509 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 46.8 mt . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.509 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 17.3 Cg_exo -67.61 152.59 85.96 Favored 'Cis proline' 0 C--N 1.354 0.847 0 C-N-CA 123.442 -1.483 . . . . 0.0 111.934 0.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.444 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 68.7 m -151.21 175.84 11.78 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.034 0.445 . . . . 0.0 111.149 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.454 HG11 HD21 ' A' ' 136' ' ' LEU . 4.4 p -132.66 161.11 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.095 179.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.687 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.2 m-85 -137.42 162.02 34.76 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.921 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 11.9 tp -109.61 135.84 49.93 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.725 -176.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.541 ' CG1' ' HA ' ' A' ' 124' ' ' ASN . 4.0 t -129.84 125.63 61.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.227 0.537 . . . . 0.0 110.654 174.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.546 ' HA ' HG12 ' A' ' 37' ' ' VAL . 28.7 t30 -80.77 167.97 19.34 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.402 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.675 ' HG2' HG13 ' A' ' 37' ' ' VAL . 16.4 mtp180 -56.48 -25.15 50.23 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -165.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.711 ' HB2' ' CD ' ' A' ' 125' ' ' GLU . 90.4 m-20 -90.01 13.16 15.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -177.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.541 ' HA ' ' CG1' ' A' ' 120' ' ' VAL . 2.8 t-20 60.48 57.55 2.77 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.407 -172.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.711 ' CD ' ' HB2' ' A' ' 123' ' ' ASN . 2.2 mp0 -109.33 134.91 51.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.178 175.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.42 107.08 2.31 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.921 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -78.78 -50.78 10.75 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.36 -173.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.09 167.31 10.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.5 -178.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.602 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -94.58 154.58 17.3 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.547 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -51.5 -41.33 48.8 Favored Glycine 0 C--N 1.33 0.231 0 O-C-N 123.434 0.458 . . . . 0.0 113.871 -175.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.463 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.6 OUTLIER -71.36 -18.09 62.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.897 0.38 . . . . 0.0 110.655 -178.016 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.508 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.8 OUTLIER -101.43 -15.14 17.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.719 -176.667 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.851 HG21 ' HG ' ' A' ' 136' ' ' LEU . 90.0 mt -77.08 99.84 2.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.163 0.506 . . . . 0.0 110.387 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.5 ptmt -74.31 87.77 2.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.202 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.415 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 33.8 t70 69.54 116.3 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.376 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.851 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.1 mp -76.13 -33.57 59.42 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.123 -177.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.519 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.3 t70 -54.15 -59.72 4.28 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.588 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 0.7 OUTLIER -51.89 -46.43 64.52 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.404 173.268 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.617 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.48 -51.71 68.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.033 0.382 . . . . 0.0 112.033 -174.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 136' ' ' LEU . 47.7 mt -57.64 -43.43 83.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.155 0.502 . . . . 0.0 110.081 177.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -59.66 -50.83 72.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.951 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.617 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 24.9 pttt -73.35 -17.13 61.32 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 42.9 mt -70.62 -40.72 72.99 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 169.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.076 175.353 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.449 -0.478 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.424 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.3 mp -89.19 114.49 27.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.01 121.83 18.18 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.477 HD11 ' OH ' ' A' ' 109' ' ' TYR . 9.4 mt -105.07 106.83 21.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.675 -174.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.436 ' CG ' ' HB3' ' A' ' 29' ' ' SER . 19.2 mt-30 -102.05 100.43 10.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.024 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.527 HD22 ' HA ' ' A' ' 97' ' ' ASP . 43.9 mt -138.38 156.7 47.35 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.3 mtmt -99.98 153.84 18.87 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 120.58 -0.448 . . . . 0.0 111.584 -172.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.76 -166.4 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.884 -174.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.543 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 6.3 mp -53.61 -46.77 70.54 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.729 177.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -68.32 -44.76 74.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.974 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.479 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 124.7 19.53 2.49 Favored Glycine 0 N--CA 1.44 -1.084 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.79 -176.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.468 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.9 OUTLIER -92.32 119.73 32.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.458 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.585 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 45.5 m -64.93 127.83 33.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.99 0.424 . . . . 0.0 111.31 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.2 mmm180 -108.84 136.32 48.59 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.436 ' HB3' ' CG ' ' A' ' 19' ' ' GLN . 57.3 p -119.0 165.46 14.08 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.629 ' HB3' HD21 ' A' ' 124' ' ' ASN . 64.7 mt -80.99 -28.59 35.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.084 0.469 . . . . 0.0 109.806 177.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 p -63.87 -20.84 66.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.086 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -81.38 -44.3 17.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 122.016 0.913 . . . . 0.0 108.572 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.471 HD23 HG13 ' A' ' 38' ' ' VAL . 2.7 tp -80.26 15.86 1.45 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.798 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.575 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 47.3 tttp -69.41 -14.29 62.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.905 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.14 10.73 65.01 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.324 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 3.4 mttm -144.97 177.9 8.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.08 0.467 . . . . 0.0 110.389 177.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.636 HG23 ' HD1' ' A' ' 69' ' ' PHE . 14.7 m -92.07 125.84 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.515 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 38.7 t -107.23 135.71 44.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 112.257 -165.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.612 HD11 HG23 ' A' ' 117' ' ' VAL . 2.0 tm? -96.38 120.22 36.3 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.478 -0.783 . . . . 0.0 108.961 170.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.1 mm -93.95 105.09 16.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 175.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.573 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 31.0 t0 -108.69 135.4 49.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 0.0 111.003 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.73 ' HB3' HD21 ' A' ' 114' ' ' LEU . 70.3 m-85 -123.4 115.44 21.62 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.288 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.1 t -155.95 174.13 15.78 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.736 0.303 . . . . 0.0 110.692 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.579 ' HB ' ' OD2' ' A' ' 77' ' ' ASP . 2.0 m -116.44 144.83 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.361 176.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.607 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 15.1 m-85 -102.24 81.03 2.03 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.6 . . . . 0.0 110.72 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.776 HD21 ' HB3' ' A' ' 79' ' ' ASP . 8.1 m-20 177.9 21.68 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.502 -1.681 . . . . 0.0 107.895 178.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -141.34 129.47 22.12 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.592 -163.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.85 78.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.039 -173.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -64.28 -21.24 66.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.011 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -74.64 -27.68 60.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.331 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.57 -51.46 35.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 110.894 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.36 -34.01 77.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.252 0.548 . . . . 0.0 110.44 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.403 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 68.3 t60 -67.45 -35.86 80.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.271 178.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -66.95 -37.3 84.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.608 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.6 tt -64.81 -42.04 95.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.361 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.48 85.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.301 0.572 . . . . 0.0 110.333 177.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -66.37 -41.33 89.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.69 176.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.437 ' HA ' ' HZ3' ' A' ' 92' ' ' TRP . 17.0 tpt180 -58.67 -31.94 68.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.102 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.83 -55.88 6.76 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.813 1.292 . . . . 0.0 107.728 -173.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.8 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -54.51 -31.74 56.67 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 112.124 -2.307 . . . . 0.0 111.388 177.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -76.72 -43.39 37.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.037 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -61.63 -22.05 64.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.323 0.582 . . . . 0.0 110.591 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -85.38 -61.62 1.72 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.546 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.569 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 95.7 m-85 -108.23 -8.79 15.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -165.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.489 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -65.97 -30.41 70.96 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 121.984 -0.447 . . . . 0.0 111.594 -176.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.8 m -68.24 -18.37 64.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.966 0.413 . . . . 0.0 111.038 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.569 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.4 mp0 -91.1 -61.97 1.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.425 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -177.4 38.88 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.876 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.636 ' HD1' HG23 ' A' ' 37' ' ' VAL . 73.5 t80 -113.17 145.67 40.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.607 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 9.3 tp10 -145.06 147.03 32.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 179.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.575 HD12 ' CE3' ' A' ' 92' ' ' TRP . 59.1 mt -111.79 131.18 63.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.982 0.42 . . . . 0.0 110.297 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.505 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.5 t80 -114.87 101.37 8.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.203 177.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 18.4 mt-30 -92.96 136.19 33.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.873 -177.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 56.4 mt -117.59 113.2 41.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.144 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 43' ' ' THR . 9.3 m -91.09 119.04 30.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.362 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.3 mt -100.97 15.23 29.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.409 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.607 ' HB2' ' H ' ' A' ' 45' ' ' TYR . 4.7 t70 -71.85 166.98 20.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.494 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.95 -18.5 46.92 Favored Glycine 0 N--CA 1.441 -1.017 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.584 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.776 ' HB3' HD21 ' A' ' 46' ' ' ASN . 9.6 t70 -111.19 114.71 28.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.305 0.574 . . . . 0.0 110.951 -178.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.573 ' HB3' ' NH1' ' A' ' 96' ' ' ARG . 11.0 pt-20 -80.15 -20.65 44.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.362 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -46.14 81.17 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.565 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -70.2 -34.65 73.19 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.543 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 12.5 t90 -59.86 -59.96 4.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.939 173.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -63.25 -40.42 97.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.275 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 59.8 m -68.31 -34.09 75.51 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.406 -178.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -23.36 29.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.062 0.458 . . . . 0.0 110.365 178.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.563 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -81.38 -18.22 46.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.405 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -53.69 -44.58 69.88 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 111.321 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.06 16.45 9.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.851 -178.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.563 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 17.7 mt -86.63 139.09 33.37 Favored Pre-proline 0 N--CA 1.452 -0.374 0 CA-C-O 121.439 0.638 . . . . 0.0 111.895 -179.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.719 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 73.6 Cg_endo -79.13 -30.78 2.51 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.818 3.012 . . . . 0.0 113.485 -176.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.719 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.2 p90 -105.28 -163.26 0.93 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.124 -173.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.64 127.39 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -177.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.8 t -129.67 115.91 18.05 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.6 m -121.95 177.96 3.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.5 -176.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' A' ' 80' ' ' GLU . 32.5 ttp180 -129.93 139.14 51.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.571 0.224 . . . . 0.0 110.593 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.527 ' HA ' HD22 ' A' ' 20' ' ' LEU . 18.4 t70 -83.32 151.07 25.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.942 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.22 -25.29 34.3 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -104.83 -12.78 16.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -173.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.73 -87.49 0.17 Allowed Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.972 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -107.22 -9.98 15.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.006 0.431 . . . . 0.0 110.973 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -103.01 22.62 13.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.114 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.435 ' HB2' HG13 ' A' ' 106' ' ' ILE . 2.2 m -69.25 133.63 48.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.067 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.547 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 14.5 m -57.1 -33.35 67.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.311 176.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -56.35 -48.07 77.54 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.393 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.435 HG13 ' HB2' ' A' ' 103' ' ' SER . 41.9 mt -55.53 -37.42 45.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.666 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 32.8 t -77.92 -22.18 50.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.857 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.9 mt -80.3 -30.65 38.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.469 -177.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.477 ' OH ' HD11 ' A' ' 18' ' ' ILE . 82.7 m-85 -85.46 -19.92 30.52 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.033 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.434 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--N 1.333 -0.152 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -162.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.73 HD21 ' HB3' ' A' ' 42' ' ' PHE . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.29 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.435 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 3.8 Cg_exo -74.74 158.3 99.0 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 124.039 -1.234 . . . . 0.0 112.015 0.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 42' ' ' PHE . 13.6 m -125.86 155.03 41.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.037 0.446 . . . . 0.0 111.375 -173.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.612 HG23 HD11 ' A' ' 39' ' ' LEU . 5.5 p -144.08 143.48 23.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.31 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.598 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 75.9 m-85 -136.07 162.37 33.08 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.81 HD13 HD11 ' A' ' 136' ' ' LEU . 27.3 tp -111.06 143.66 41.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.515 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 53.5 t -133.84 126.6 51.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.532 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.692 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.5 p30 -83.29 167.97 17.12 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 49.2 ptt85 -63.97 1.57 0.65 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -168.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -98.5 7.06 46.64 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.629 HD21 ' HB3' ' A' ' 30' ' ' LEU . 2.7 t-20 60.99 57.33 2.58 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.845 -170.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.692 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 39.8 mt-10 -129.27 145.27 51.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.355 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.04 110.93 4.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.277 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.406 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 7.7 m -80.51 -47.6 14.01 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.693 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.21 165.81 10.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.212 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.619 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 12.1 mpt_? -92.2 162.09 14.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 175.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.06 -44.82 92.91 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 121.485 -0.388 . . . . 0.0 112.845 -176.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.639 ' CD ' ' H ' ' A' ' 131' ' ' GLU . 0.2 OUTLIER -68.88 -23.07 64.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.155 0.502 . . . . 0.0 110.481 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -92.68 -1.87 56.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.95 -176.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.63 HG21 HD13 ' A' ' 136' ' ' LEU . 96.5 mt -99.54 99.85 9.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.558 0.694 . . . . 0.0 110.302 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.424 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 13.1 ptmm? -60.51 -36.38 78.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.065 176.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.424 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 23.5 t70 -166.0 116.75 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.353 -176.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.81 HD11 HD13 ' A' ' 119' ' ' LEU . 1.8 tp -75.96 -26.66 57.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.57 -175.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -54.89 -53.43 55.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.719 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -58.53 -51.1 71.31 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.029 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.639 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.66 -54.54 42.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.905 -173.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.8 HD12 HD12 ' A' ' 60' ' ' LEU . 38.5 mt -63.33 -35.23 71.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.796 0.331 . . . . 0.0 111.008 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -62.39 -49.8 74.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.006 0.431 . . . . 0.0 110.462 178.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.93 -23.73 63.26 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.5 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.639 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 78.4 mt -66.85 -40.26 87.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.104 0.478 . . . . 0.0 110.103 173.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 96.7 mt . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.823 177.73 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.6 tp . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 120.921 0.391 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.474 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -100.81 103.68 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.49 108.52 2.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.335 0.588 . . . . 0.0 110.521 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 29' ' ' SER . 19.4 mm -87.15 124.2 40.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.645 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.575 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 11.0 mt-30 -120.86 100.43 7.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.89 0.376 . . . . 0.0 111.149 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.3 mt -142.03 153.88 44.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.225 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 92.6 mttt -79.81 144.54 33.44 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.244 0.545 . . . . 0.0 110.528 178.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.582 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 3.3 p-10 -90.55 -169.84 2.53 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.04 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.498 ' CD2' ' HA ' ' A' ' 88' ' ' ASP . 37.9 tp -59.0 -36.4 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.42 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HB2' HD22 ' A' ' 26' ' ' ASN . 91.6 mttt -69.71 -24.59 63.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.166 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.63 15.22 21.41 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.218 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.543 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 53.7 m-80 -99.51 122.52 42.71 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 17.0 m -66.72 106.87 1.96 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 172.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.575 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -86.82 142.43 28.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.082 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.54 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 73.8 p -121.72 156.95 32.01 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 172.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.652 ' HB3' HD21 ' A' ' 124' ' ' ASN . 53.7 mt -74.38 -27.02 60.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.091 0.472 . . . . 0.0 109.868 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.8 p -67.81 -14.79 63.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.187 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -91.28 -40.25 11.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 0.0 109.446 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.563 HD23 HG13 ' A' ' 38' ' ' VAL . 3.4 tp -77.11 3.65 12.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.346 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 36.9 ttpt -61.22 -18.42 58.23 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.436 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -71.73 -12.39 74.22 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.588 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -123.7 -177.89 3.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.98 0.419 . . . . 0.0 110.103 177.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.684 HG23 ' HD1' ' A' ' 69' ' ' PHE . 5.5 m -93.71 126.75 46.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 167.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.566 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 22.1 t -102.16 129.45 53.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.255 0.55 . . . . 0.0 112.132 -165.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.727 HD12 ' HZ ' ' A' ' 69' ' ' PHE . 6.2 tt -92.87 110.06 21.51 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 171.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.639 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 35.0 mm -84.74 106.15 14.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.99 0.424 . . . . 0.0 110.31 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.651 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 5.4 t70 -104.14 134.61 47.11 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.123 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.4 ' HB3' HD11 ' A' ' 114' ' ' LEU . 17.0 m-85 -119.54 108.91 15.09 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.503 ' O ' ' HA ' ' A' ' 75' ' ' SER . 6.4 t -143.85 -175.45 4.59 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.219 0.533 . . . . 0.0 110.75 -174.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.766 HG13 ' HB2' ' A' ' 47' ' ' ASN . 2.5 p -145.12 128.15 10.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.653 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.516 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 30.1 m-85 -78.12 79.4 4.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.853 0.835 . . . . 0.0 109.807 178.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 176.1 -27.56 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 113.543 -1.662 . . . . 0.0 109.687 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.766 ' HB2' HG13 ' A' ' 44' ' ' VAL . 41.7 t-20 -73.21 135.33 44.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.729 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.82 68.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.345 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.21 -24.43 63.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.8 m -63.29 -28.98 70.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -176.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.38 -59.62 4.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.833 0.349 . . . . 0.0 111.256 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.05 -32.72 73.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.922 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.428 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 67.8 t60 -62.46 -42.96 99.84 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.022 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -70.04 -21.59 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.662 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.3 -44.02 65.96 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 177.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.3 75.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.36 0.6 . . . . 0.0 110.091 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.466 ' HB3' HD13 ' A' ' 71' ' ' ILE . 82.9 mt -65.96 -40.61 91.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.837 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.526 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 28.5 tpt180 -60.68 -28.82 68.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.22 177.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.55 -56.97 4.14 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 122.528 1.156 . . . . 0.0 108.148 -171.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.708 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -57.91 -32.48 67.79 Favored 'General case' 0 N--CA 1.425 -1.68 0 CA-C-N 112.348 -2.205 . . . . 0.0 111.515 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -75.65 -44.43 42.6 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.293 0.568 . . . . 0.0 109.647 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 15.1 t30 -59.75 -26.11 65.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.866 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -83.55 -61.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.701 -1.136 . . . . 0.0 112.434 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -105.69 -7.2 18.58 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -163.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.582 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.17 -35.37 69.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.12 0.418 . . . . 0.0 111.93 -177.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 m -66.21 -12.44 56.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.183 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.445 ' HB2' HD13 ' A' ' 144' ' ' LEU . 50.3 mt-30 -106.27 17.58 23.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.173 -178.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.02 46.39 3.11 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.113 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.727 ' HZ ' HD12 ' A' ' 39' ' ' LEU . 46.9 t80 -120.8 136.24 54.95 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -142.59 142.79 32.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.193 0.52 . . . . 0.0 110.277 -176.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.482 HG23 HD22 ' A' ' 39' ' ' LEU . 60.0 mt -102.52 132.66 48.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.3 -176.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.506 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.7 t80 -115.7 101.2 8.62 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.676 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.651 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 2.0 mt-30 -90.72 128.08 36.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.469 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.3 mt -109.01 109.36 28.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.706 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 43' ' ' THR . 1.1 m -93.94 142.1 27.76 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.454 -178.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 mt -115.73 27.79 9.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.835 0.35 . . . . 0.0 110.96 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.4 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.7 p30 -84.1 178.48 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.871 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -137.73 35.43 2.05 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.983 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -138.36 134.14 33.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.984 0.421 . . . . 0.0 110.363 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -77.45 -31.42 53.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 51.0 m80 -68.79 -51.88 36.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.439 -167.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -71.49 -44.55 64.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.516 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 56.7 t90 -59.68 -49.6 77.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.491 -179.221 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 51.9 tttm -61.33 -61.72 2.34 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -177.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.8 m -55.44 -38.77 69.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.037 -173.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.484 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.4 m -74.48 -39.51 62.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.421 -177.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.407 ' HA ' HD12 ' A' ' 90' ' ' LEU . . . -87.44 -20.87 26.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.062 0.458 . . . . 0.0 111.458 -174.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.537 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -60.0 -35.54 75.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.532 -176.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -96.26 8.52 43.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.732 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 86' ' ' SER . 25.6 mt -93.82 149.05 36.4 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-O 121.249 0.547 . . . . 0.0 111.55 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.581 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 98.6 Cg_endo -74.32 -56.96 0.07 OUTLIER 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.59 2.86 . . . . 0.0 113.86 -175.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.581 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.5 p90 -83.37 -166.5 1.39 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.946 -169.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -87.52 133.32 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.813 -171.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 83.3 m -133.14 110.66 10.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.904 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.582 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 16.0 m -116.34 163.34 13.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.928 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -129.98 144.04 51.12 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.445 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -76.48 162.03 28.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.103 178.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.54 -34.95 65.45 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -177.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.425 ' HA ' HD22 ' A' ' 99' ' ' ASN . 1.0 OUTLIER -122.43 -11.27 8.34 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.751 -174.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.76 -113.72 3.82 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.252 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.31 5.58 4.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.851 0.358 . . . . 0.0 111.892 -174.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -110.29 9.51 23.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.973 0.416 . . . . 0.0 110.206 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 14.4 t -63.83 130.2 43.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.127 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.7 m -58.49 -28.95 65.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.699 -177.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.49 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 80.3 m-85 -61.54 -36.9 81.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.007 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.08 -34.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.603 -175.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 41.2 m -80.09 -18.6 49.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.921 0.391 . . . . 0.0 111.115 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.4 mt -81.0 -33.44 33.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.07 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.49 ' HE2' ' HB3' ' A' ' 105' ' ' TYR . 78.3 m-85 -83.76 -9.43 58.81 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.81 178.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 CA--C 1.516 -0.343 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 -168.261 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.606 ' CG ' ' HA ' ' A' ' 115' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.413 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.606 ' HA ' ' CG ' ' A' ' 114' ' ' LEU . 7.5 Cg_exo -71.24 162.83 87.21 Favored 'Cis proline' 0 C--N 1.352 0.722 0 C-N-CA 124.64 -0.983 . . . . 0.0 113.409 1.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 49.2 m -143.82 173.85 11.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.386 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.83 156.41 17.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.449 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.639 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 78.3 m-85 -146.36 158.68 43.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.772 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 17.7 tp -112.57 145.31 40.56 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.924 -177.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.599 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 34.6 t -138.5 126.12 28.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.645 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -80.92 168.26 18.93 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -76.72 16.3 0.53 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -172.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -105.8 10.59 32.58 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 167.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.652 HD21 ' HB3' ' A' ' 30' ' ' LEU . 1.9 t-20 56.48 63.75 1.88 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.908 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.599 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 46.1 mt-10 -127.46 140.87 51.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.673 176.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.5 tt -69.68 107.75 3.58 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.772 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 52.6 m -74.53 -52.98 10.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.335 -177.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -165.56 164.5 19.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.116 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.583 ' O ' HG13 ' A' ' 133' ' ' ILE . 99.4 mtt180 -102.06 151.62 21.93 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.441 ' O ' ' HB2' ' A' ' 131' ' ' GLU . . . -54.83 155.62 8.39 Favored Glycine 0 N--CA 1.452 -0.237 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 173.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 130' ' ' GLY . 26.2 mm-40 71.84 -40.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.119 0.568 . . . . 0.0 110.742 -172.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.477 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.8 OUTLIER -80.39 -29.86 37.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.954 0.407 . . . . 0.0 110.026 177.131 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 129' ' ' ARG . 51.3 mt -59.52 -44.32 92.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.807 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 132' ' ' ASN . 50.9 mttp 74.29 -58.47 0.58 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.428 0.691 . . . . 0.0 110.851 179.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -139.77 110.47 6.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.541 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.888 HD13 HD11 ' A' ' 140' ' ' ILE . 0.3 OUTLIER -77.11 -28.01 54.25 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.11 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.412 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.0 t70 -57.21 -52.27 65.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.693 0.282 . . . . 0.0 111.012 -172.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.46 -34.97 79.13 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.015 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.591 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -63.26 -52.36 62.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.694 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.888 HD11 HD13 ' A' ' 136' ' ' LEU . 30.1 mt -65.15 -40.04 87.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -62.75 -44.22 96.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.845 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -72.02 -19.7 61.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 79.1 mt -68.48 -39.76 81.22 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.637 0.732 . . . . 0.0 109.349 171.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.445 HD13 ' HB2' ' A' ' 67' ' ' GLN . 88.4 mt . . . . . 0 C--N 1.321 -0.668 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.918 177.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.7 tp . . . . . 0 N--CA 1.443 -0.823 0 CA-C-O 121.286 0.565 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.477 ' O ' HD12 ' A' ' 30' ' ' LEU . 95.0 mt -87.6 101.94 11.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.885 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -68.73 107.87 3.18 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.803 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 29' ' ' SER . 23.4 mm -87.93 113.8 25.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.222 -178.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.536 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 80.3 mt-30 -108.78 100.26 9.51 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.377 0.608 . . . . 0.0 110.864 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.641 ' HB2' HG11 ' A' ' 95' ' ' VAL . 45.5 mt -137.99 159.98 40.58 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 41.6 mttp -89.01 135.4 33.57 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.154 0.502 . . . . 0.0 111.532 -177.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.562 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 21.5 p30 -81.79 -167.26 1.45 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.587 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.705 HD21 ' HB3' ' A' ' 87' ' ' ALA . 91.1 mt -50.33 -35.98 30.08 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -83.86 -6.54 59.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.718 -176.502 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.85 12.76 70.96 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -173.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.543 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.8 OUTLIER -88.06 112.96 23.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.262 -0.469 . . . . 0.0 110.181 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.587 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.0 m -61.88 111.38 1.87 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.154 0.502 . . . . 0.0 111.144 177.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.481 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 14.4 mmt180 -90.64 142.52 27.67 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.55 173.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.536 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 79.6 p -119.22 165.6 14.03 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 171.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.76 ' HB3' HD21 ' A' ' 124' ' ' ASN . 62.8 mt -79.61 -24.93 41.63 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 p -68.09 -18.26 64.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.938 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -83.3 -41.36 18.37 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.66 0.743 . . . . 0.0 109.449 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.727 HD23 HG13 ' A' ' 38' ' ' VAL . 4.6 tp -76.1 -7.19 54.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.727 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.603 ' NZ ' ' HB3' ' A' ' 34' ' ' LYS . 1.1 ttpm? -61.17 99.83 0.11 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.128 175.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.88 -30.76 0.21 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -174.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.608 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 86.4 mttt -113.2 177.5 4.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 167.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.812 HG23 ' HD1' ' A' ' 69' ' ' PHE . 13.0 m -82.35 130.72 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.727 HG13 HD23 ' A' ' 33' ' ' LEU . 43.6 t -101.72 124.03 55.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.178 0.514 . . . . 0.0 111.751 -167.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.552 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.4 tp -94.28 112.6 24.4 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.765 175.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.63 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.4 mm -85.2 105.27 13.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.514 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 29.2 t70 -107.8 110.83 22.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.744 -178.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.44 ' HB3' HD13 ' A' ' 114' ' ' LEU . 36.1 m-85 -95.05 105.18 17.08 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.539 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.6 t -137.56 -175.84 4.2 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.402 0.62 . . . . 0.0 111.563 -170.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.559 HG23 ' HB3' ' A' ' 77' ' ' ASP . 0.2 OUTLIER -143.0 122.39 8.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.782 178.654 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.706 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 49.4 m-85 -81.27 79.97 7.8 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 9.7 t30 174.79 -30.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.846 175.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.498 ' HB2' HG13 ' A' ' 44' ' ' VAL . 38.4 t-20 -66.82 134.53 52.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.507 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.27 -30.87 70.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.305 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.8 tpt -64.29 -30.1 71.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.906 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 m -68.46 -28.27 66.9 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.356 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.91 -53.75 45.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.864 0.364 . . . . 0.0 110.929 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.78 63.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.198 0.523 . . . . 0.0 110.604 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.493 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.1 t60 -65.3 -44.23 88.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.041 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.469 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.6 m-20 -66.3 -27.15 67.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.647 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.44 -55.11 34.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.262 0.553 . . . . 0.0 109.839 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.57 -32.92 73.03 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.845 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.1 mt -64.45 -39.48 93.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.864 176.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -62.35 -33.34 74.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.492 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.542 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 2.2 tt0 -71.77 -52.61 16.79 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.815 HD12 HD12 ' A' ' 140' ' ' ILE . 1.5 mm? -51.69 -34.97 40.82 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 112.952 -1.931 . . . . 0.0 111.577 177.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -75.9 -41.52 51.71 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.189 0.518 . . . . 0.0 110.065 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.401 HD22 ' HA ' ' A' ' 62' ' ' ASN . 8.9 m120 -65.28 -21.43 66.72 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.832 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.611 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 36.3 mttm -80.99 -61.73 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.602 -178.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.428 ' HE1' ' HG3' ' A' ' 141' ' ' LYS . 71.1 m-85 -111.21 -10.91 14.27 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -163.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.597 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.88 -31.31 71.58 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.307 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.5 m -64.18 -24.88 67.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.978 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -96.12 -6.93 37.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.027 0.442 . . . . 0.0 110.67 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.426 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 117.27 64.41 0.33 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.638 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.812 ' HD1' HG23 ' A' ' 37' ' ' VAL . 34.4 t80 -134.44 141.93 46.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.664 ' HG2' HD11 ' A' ' 33' ' ' LEU . 7.9 tp10 -140.24 148.6 41.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.351 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.569 ' HB ' ' CG ' ' A' ' 92' ' ' TRP . 48.0 mt -112.51 124.93 69.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.018 0.437 . . . . 0.0 109.963 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.581 ' CE1' HG21 ' A' ' 95' ' ' VAL . 88.2 t80 -109.86 100.43 9.41 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.514 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.4 mt-30 -92.2 135.43 34.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.092 0.472 . . . . 0.0 111.29 -178.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 68.2 mt -117.95 110.77 31.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.458 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.73 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 34.6 p -85.35 136.95 33.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.689 0.28 . . . . 0.0 111.114 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.462 HD22 ' H ' ' A' ' 101' ' ' ALA . 50.8 mt -105.39 13.74 29.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.812 0.339 . . . . 0.0 110.829 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.73 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 2.2 p-10 -86.47 163.04 17.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.969 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -98.09 -29.06 7.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.768 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.477 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 13.5 t0 -76.45 110.19 10.79 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.397 0.618 . . . . 0.0 110.669 -178.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.604 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 32.1 tt0 -70.93 -19.94 62.52 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.334 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . 0.477 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.0 OUTLIER -71.53 -45.04 63.48 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.835 -175.756 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -71.14 -44.95 64.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.977 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.517 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 39.2 t90 -55.9 -42.84 76.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.354 172.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.604 ' HB2' ' O ' ' A' ' 80' ' ' GLU . 11.5 tppt? -60.91 -57.47 12.52 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.96 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 p -65.14 -41.42 94.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.296 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.401 ' HB2' ' HD2' ' A' ' 45' ' ' TYR . 38.2 m -67.69 -37.46 82.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.424 -178.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.705 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -86.58 -17.74 33.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.604 -177.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -50.18 -35.04 24.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.039 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -109.76 16.04 22.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.536 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 87' ' ' ALA . 27.8 mt -89.63 146.88 36.53 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.144 0.497 . . . . 0.0 111.525 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.709 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 93.1 Cg_endo -79.96 -40.49 0.23 Allowed 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 123.694 2.929 . . . . 0.0 114.027 -176.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.709 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.0 p90 -96.15 -168.09 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.783 0.325 . . . . 0.0 111.627 -170.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.411 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 24.8 t -81.61 120.29 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 121.148 0.499 . . . . 0.0 110.528 -171.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 35.0 m -116.3 106.54 13.77 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.956 -176.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.641 HG11 ' HB2' ' A' ' 20' ' ' LEU . 7.9 t -121.29 159.69 23.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.463 -172.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.567 HH12 ' HB2' ' A' ' 80' ' ' GLU . 54.0 ttp180 -120.34 141.78 49.73 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.763 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.527 ' HA ' HD13 ' A' ' 20' ' ' LEU . 30.4 t70 -73.2 160.53 31.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.321 177.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.79 -28.43 33.21 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -174.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.484 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 33.4 t30 -122.49 -12.69 8.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 112.46 -172.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.55 84.72 0.23 Allowed Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.651 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.462 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 75.19 -32.78 0.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.46 0.704 . . . . 0.0 111.926 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.484 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 52.3 m-85 -86.28 37.04 0.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.066 0.46 . . . . 0.0 110.016 176.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.432 ' HB3' HG13 ' A' ' 106' ' ' ILE . 23.1 t -87.22 136.73 32.82 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.346 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.8 m -61.83 -29.25 70.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.06 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -64.79 -41.42 95.84 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.843 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.432 HG13 ' HB3' ' A' ' 103' ' ' SER . 71.7 mt -56.81 -38.78 60.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.165 -178.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 36.1 t -68.91 -28.62 66.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.758 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.43 -26.68 61.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.94 0.4 . . . . 0.0 110.56 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -83.85 -1.55 54.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.751 0 CA-C-O 121.805 0.812 . . . . 0.0 110.198 -177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.621 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 53.8 mt . . . . . 0 CA--C 1.533 0.294 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.621 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.18 158.89 91.82 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.614 0.898 . . . . 0.0 113.582 1.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.1 m -155.22 164.3 38.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.012 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.43 154.05 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.63 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.1 m-85 -132.35 161.86 32.52 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.692 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.4 tp -110.85 131.67 54.85 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.946 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 23.0 t -129.31 127.4 65.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 174.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.475 ' HB3' HD22 ' A' ' 143' ' ' LEU . 8.0 p30 -83.78 170.76 13.82 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.029 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -60.81 -12.67 11.54 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 124.272 0.983 . . . . 0.0 113.544 -164.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -95.71 13.46 26.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.76 HD21 ' HB3' ' A' ' 30' ' ' LEU . 1.6 t-20 61.01 54.78 3.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.841 -174.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.474 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.9 mm-40 -122.25 137.36 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.54 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 126' ' ' LEU . 10.0 mt -68.49 112.27 5.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 0.0 110.437 175.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.692 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 24.4 m -81.37 -55.02 4.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.005 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -168.33 172.39 8.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.46 -175.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.677 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -93.94 161.88 14.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 108.96 176.001 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.507 ' HA2' HD12 ' A' ' 133' ' ' ILE . . . -48.05 -48.99 24.91 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 114.7 0.64 . . . . 0.0 114.7 -172.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.443 ' HG2' HD22 ' A' ' 132' ' ' ASN . 0.0 OUTLIER -74.85 -26.87 59.99 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 117.028 0.414 . . . . 0.0 110.739 -176.747 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.443 HD22 ' HG2' ' A' ' 131' ' ' GLU . 0.9 OUTLIER -72.35 -34.18 67.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.877 175.416 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.888 HG21 ' HG ' ' A' ' 136' ' ' LEU . 49.1 mt -69.46 -40.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.56 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.587 ' HG3' ' C ' ' A' ' 133' ' ' ILE . 0.0 OUTLIER 48.45 -86.51 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.287 0.992 . . . . 0.0 112.023 -173.273 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -88.43 84.78 6.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.093 -176.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.888 ' HG ' HG21 ' A' ' 133' ' ' ILE . 4.6 mp -60.6 -32.53 71.65 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.719 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -52.85 -56.09 18.36 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.812 0.339 . . . . 0.0 110.365 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.33 -41.64 93.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.777 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -58.09 -54.88 42.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.614 -177.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.815 HD12 HD12 ' A' ' 60' ' ' LEU . 35.8 mt -65.35 -35.23 74.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.862 0.363 . . . . 0.0 110.948 -177.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.428 ' HG3' ' HE1' ' A' ' 64' ' ' TYR . 3.5 ttmp? -60.15 -42.52 95.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.156 0.503 . . . . 0.0 109.991 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -82.84 -18.4 40.54 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.861 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 55.7 mt -62.2 -38.42 89.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.419 0.628 . . . . 0.0 109.544 170.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 44.5 mt . . . . . 0 N--CA 1.447 -0.583 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.158 179.423 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.502 HD13 HG11 ' A' ' 120' ' ' VAL . 4.9 tp . . . . . 0 N--CA 1.447 -0.614 0 CA-C-O 121.057 0.456 . . . . 0.0 110.991 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.416 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.1 mp -94.39 102.73 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 168.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.92 132.47 44.4 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.403 ' H ' ' HG ' ' A' ' 30' ' ' LEU . 8.4 mt -113.61 105.54 18.94 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.25 -176.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.0 OUTLIER -93.88 101.44 13.52 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.267 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.507 ' HB2' HG11 ' A' ' 95' ' ' VAL . 78.4 mt -137.54 155.66 48.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.4 mtmt -89.0 137.99 31.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.495 0.664 . . . . 0.0 111.425 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.619 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -87.64 -169.89 2.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.87 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.677 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 36.5 tp -48.33 -39.52 22.27 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.603 0.761 . . . . 0.0 112.716 -178.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.9 mtmm -74.98 -13.6 60.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.999 0.428 . . . . 0.0 111.738 -177.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.63 17.25 55.17 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 -175.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.473 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.9 OUTLIER -99.56 127.56 45.64 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.667 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.5 m -67.97 113.78 5.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.491 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 16.5 mmm180 -92.45 142.29 27.58 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.441 ' O ' ' HB3' ' A' ' 32' ' ' ASP . 2.0 m -134.31 163.66 29.15 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 174.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.487 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 65.4 mt -80.08 -32.88 39.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.553 -172.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.7 p -64.21 -14.32 54.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.018 0.437 . . . . 0.0 111.116 173.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t0 -82.6 -45.07 15.03 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -76.35 0.13 20.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.473 -1.24 . . . . 0.0 110.659 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.5 ' HA ' HD22 ' A' ' 124' ' ' ASN . 7.4 ttpm? -58.26 134.58 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.736 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.69 -29.88 5.5 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -174.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.581 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 61.4 mttm -112.38 166.15 11.55 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.761 HG23 ' HD1' ' A' ' 69' ' ' PHE . 8.5 m -84.27 124.44 39.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.626 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 99.4 t -102.06 132.03 48.86 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 121.641 0.734 . . . . 0.0 111.045 -169.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.645 HD22 HG23 ' A' ' 71' ' ' ILE . 6.4 tt -94.38 104.27 16.25 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 172.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.441 HG13 ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -88.46 104.34 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.281 178.339 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.571 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.2 t70 -103.26 142.02 34.9 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.065 -175.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -124.3 95.93 4.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 173.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.442 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.7 t -123.7 -175.71 3.28 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.296 -174.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.561 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -137.78 111.51 8.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.08 0.467 . . . . 0.0 110.628 178.85 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.492 ' CD1' ' HB2' ' A' ' 75' ' ' SER . 41.7 m-85 -72.55 79.18 1.06 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 51.4 t30 172.51 -25.59 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.224 -177.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.561 ' HB2' HG13 ' A' ' 44' ' ' VAL . 5.6 t-20 -82.29 150.15 27.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.643 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.02 -30.95 62.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -71.77 -20.17 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.75 -176.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.0 m -63.97 -24.69 67.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.623 0.249 . . . . 0.0 111.329 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.05 -50.23 74.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.802 0.334 . . . . 0.0 111.269 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.61 -31.94 60.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.103 0.478 . . . . 0.0 110.814 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.41 ' HE2' ' CG ' ' A' ' 41' ' ' ASP . 86.3 t60 -63.72 -45.11 91.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.715 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.71 -18.78 62.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.836 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -73.85 -44.31 55.92 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.95 -37.77 77.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.395 0.616 . . . . 0.0 109.882 175.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.87 -40.31 91.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.926 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.478 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 13.1 tpt180 -56.14 -35.96 67.72 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.958 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.55 -50.96 11.49 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -172.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.912 HD12 HD12 ' A' ' 140' ' ' ILE . 1.9 mm? -55.97 -31.34 62.9 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 113.262 -1.79 . . . . 0.0 111.441 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.416 ' HD1' HG13 ' A' ' 71' ' ' ILE . 23.9 t80 -82.83 -44.03 15.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.387 0.613 . . . . 0.0 109.876 -178.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 29.1 t30 -60.65 -24.82 65.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.116 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -85.95 -60.67 1.95 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.815 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.57 -12.51 16.4 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -164.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.552 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.41 -31.77 70.7 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -174.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 m -60.35 -28.73 68.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.168 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.555 ' HG3' HD13 ' A' ' 144' ' ' LEU . 9.2 pt20 -108.68 29.77 7.12 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 99.02 48.62 1.71 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.067 -1.063 . . . . 0.0 112.852 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.761 ' HD1' HG23 ' A' ' 37' ' ' VAL . 37.3 t80 -132.23 140.5 48.7 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.426 ' OE1' HG23 ' A' ' 93' ' ' VAL . 0.3 OUTLIER -140.62 151.2 44.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.493 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.645 HG23 HD22 ' A' ' 39' ' ' LEU . 65.2 mt -114.24 111.0 34.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.714 0.769 . . . . 0.0 110.394 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.537 ' CE1' HG21 ' A' ' 95' ' ' VAL . 91.5 t80 -96.56 99.17 10.82 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.571 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 8.4 tt0 -100.96 114.35 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.349 -171.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.413 HD11 ' HE2' ' A' ' 72' ' ' TYR . 50.0 mt -96.71 124.6 49.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.218 177.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.492 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 27.9 t -96.93 137.95 35.23 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.904 0.383 . . . . 0.0 110.472 177.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 31.0 mt -112.08 34.32 4.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.653 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.421 ' OD2' ' HD3' ' A' ' 96' ' ' ARG . 3.6 p30 -82.92 -176.16 6.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.449 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.7 35.98 1.88 Allowed Glycine 0 N--CA 1.444 -0.773 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.45 176.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -145.35 115.83 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.359 0.599 . . . . 0.0 110.995 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.505 ' HA ' HH12 ' A' ' 96' ' ' ARG . 4.9 tp10 -64.65 -36.0 82.84 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.096 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -61.51 -56.38 20.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.585 -170.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -68.55 -41.05 80.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.76 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.677 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 53.2 t90 -60.81 -55.12 36.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.545 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.412 ' HE2' HD12 ' A' ' 23' ' ' LEU . 2.6 ttmt -57.32 -46.93 82.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.899 0.381 . . . . 0.0 111.362 -176.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 21.3 m -70.2 -42.47 72.3 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.804 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.6 t -75.43 -42.38 53.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.05 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.601 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -64.59 -32.13 73.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.863 0.363 . . . . 0.0 110.99 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.53 -27.84 68.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.413 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.61 -1.99 42.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.528 -176.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.476 HD12 ' OH ' ' A' ' 45' ' ' TYR . 26.8 mt -96.7 148.59 34.66 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 121.171 0.51 . . . . 0.0 112.229 -176.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.618 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 89.4 Cg_endo -74.41 -51.79 0.13 Allowed 'Trans proline' 0 N--CA 1.478 0.611 0 C-N-CA 124.128 3.219 . . . . 0.0 114.423 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.618 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -83.57 -178.95 7.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.627 -172.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.426 HG23 ' OE1' ' A' ' 70' ' ' GLU . 99.1 t -70.2 125.19 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 121.294 0.568 . . . . 0.0 111.052 -173.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.601 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 1.8 p -113.97 105.21 12.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.396 -176.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.619 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 1.7 t -115.36 161.51 14.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.379 -172.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.505 HH12 ' HA ' ' A' ' 80' ' ' GLU . 46.9 ttp180 -140.49 140.12 35.25 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.255 170.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -93.94 149.33 21.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.63 175.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.65 -1.75 47.84 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -173.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -110.01 -12.49 14.53 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.106 -0.371 . . . . 0.0 111.702 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.21 -117.1 8.66 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.119 -178.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -91.63 25.15 2.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.86 0.362 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -130.22 17.27 5.52 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.419 178.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.543 ' HB2' HG13 ' A' ' 106' ' ' ILE . 10.5 m -61.96 134.55 56.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.204 -178.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 4.0 m -55.78 -35.22 66.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.012 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -57.08 -47.56 80.72 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.543 HG13 ' HB2' ' A' ' 103' ' ' SER . 68.2 mt -57.93 -37.76 62.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.928 -177.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 16.0 m -70.33 -36.19 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.898 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.5 mt -66.01 -34.87 79.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.305 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -71.44 -29.75 65.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.667 0.27 . . . . 0.0 110.853 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -163.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 3.6 mm? . . . . . 0 C--O 1.236 0.355 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.547 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.7 Cg_endo -73.36 153.5 99.17 Favored 'Cis proline' 0 C--N 1.35 0.607 0 C-N-CA 123.811 -1.329 . . . . 0.0 113.163 0.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.431 ' HB2' HD13 ' A' ' 114' ' ' LEU . 30.4 m -151.13 178.57 9.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.383 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.617 HG12 ' HA3' ' A' ' 130' ' ' GLY . 4.3 p -139.36 162.21 27.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.441 ' HB2' HG13 ' A' ' 40' ' ' ILE . 91.6 m-85 -144.27 157.17 44.42 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.871 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.7 tp -112.77 144.92 41.48 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.079 -0.248 . . . . 0.0 110.681 -177.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 126' ' ' LEU . 5.1 m -141.67 140.5 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 120.853 0.359 . . . . 0.0 110.9 169.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.63 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 5.3 p30 -80.49 173.83 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.603 ' HG3' HG13 ' A' ' 37' ' ' VAL . 98.2 mtt180 -52.55 -30.03 28.53 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.147 1.165 . . . . 0.0 114.147 -171.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -76.79 4.93 8.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.094 0.474 . . . . 0.0 110.243 177.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.5 HD22 ' HA ' ' A' ' 34' ' ' LYS . 3.2 m-80 58.44 61.95 2.11 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.221 -173.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.63 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 46.1 mt-10 -124.94 132.18 53.32 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.85 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.643 ' HA ' HG12 ' A' ' 120' ' ' VAL . 1.2 tt -58.91 113.39 2.05 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 123.895 0.747 . . . . 0.0 110.504 -174.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.871 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.6 m -77.88 -55.29 5.43 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.581 -179.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.64 ' HB1' HD21 ' A' ' 132' ' ' ASN . . . -172.71 171.48 4.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.299 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.622 ' HD3' ' OE2' ' A' ' 131' ' ' GLU . 57.9 mtt180 -90.48 144.91 25.33 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.11 -178.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.617 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -64.48 -17.77 62.55 Favored Glycine 0 C--N 1.319 -0.387 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 172.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.622 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 10.9 mt-10 -64.94 -24.71 67.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.099 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.64 HD21 ' HB1' ' A' ' 128' ' ' ALA . 1.6 p-10 -118.49 -23.14 7.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.562 179.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.56 HD11 ' HB3' ' A' ' 128' ' ' ALA . 70.5 mt -79.41 101.85 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.919 0.39 . . . . 0.0 110.461 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.474 ' H ' ' HG2' ' A' ' 134' ' ' LYS . 11.3 ptmm? -84.76 -32.35 23.47 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -121.61 93.29 3.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.538 ' O ' HG13 ' A' ' 140' ' ' ILE . 5.8 mp -75.85 -25.52 56.29 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.228 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.574 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.1 t70 -49.37 -58.01 5.88 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 123.433 0.458 . . . . 0.0 110.931 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -60.7 -42.98 98.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.813 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -57.81 -53.1 61.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.456 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.912 HD12 HD12 ' A' ' 60' ' ' LEU . 33.7 mt -64.54 -40.56 89.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.889 0.376 . . . . 0.0 110.949 -178.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -58.92 -47.28 85.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.436 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -68.41 -20.47 64.67 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.766 -177.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 87.5 mt -72.8 -40.81 65.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.263 0.554 . . . . 0.0 110.239 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.555 HD13 ' HG3' ' A' ' 67' ' ' GLN . 97.6 mt . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.334 -176.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.613 HD11 HD13 ' A' ' 30' ' ' LEU . 4.9 tp . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 121.232 0.539 . . . . 0.0 110.306 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.467 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.4 mp -66.55 120.04 12.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.66 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.66 107.69 4.63 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.057 0.456 . . . . 0.0 110.017 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.678 ' O ' ' HA ' ' A' ' 29' ' ' SER . 12.9 mt -106.18 110.3 30.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.872 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.548 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 95.1 mt-30 -107.47 101.4 10.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.122 0.486 . . . . 0.0 111.33 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.59 ' HB2' HG11 ' A' ' 95' ' ' VAL . 28.4 mt -137.19 157.99 45.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.721 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 47.9 mttm -94.8 158.95 15.27 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.391 0.615 . . . . 0.0 111.675 -175.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -95.44 -169.74 2.03 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.39 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.775 HD11 ' HB1' ' A' ' 87' ' ' ALA . 6.4 mp -52.97 -41.5 64.62 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.6 0.562 . . . . 0.0 111.844 -176.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.565 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 67.5 mttm -81.3 -16.62 51.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.1 -175.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.47 6.88 40.81 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.959 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.565 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 2.2 m-80 -80.99 126.36 31.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.3 m -74.86 112.82 11.47 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.959 0.409 . . . . 0.0 110.637 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HG3' HG13 ' A' ' 93' ' ' VAL . 3.6 mmm-85 -100.49 143.47 30.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.678 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.2 p -127.42 175.93 7.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.278 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.613 HD13 HD11 ' A' ' 15' ' ' ILE . 97.2 mt -78.9 -10.95 59.97 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.632 ' HA ' ' HB2' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -88.46 2.27 53.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.334 169.524 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.476 ' HB2' ' H ' ' A' ' 29' ' ' SER . 29.1 t70 -95.94 -33.51 12.15 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.91 HD13 HG21 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -111.47 18.24 19.33 Favored 'General case' 0 C--O 1.249 1.073 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.762 173.298 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.632 ' HB2' ' HA ' ' A' ' 31' ' ' THR . 56.4 tttp -70.93 66.64 0.38 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.202 179.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.41 -23.63 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.032 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.863 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.735 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -137.76 -174.41 3.77 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.95 174.62 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.748 HG22 ' H ' ' A' ' 122' ' ' ARG . 54.6 t -72.17 118.27 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -176.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.91 HG21 HD13 ' A' ' 33' ' ' LEU . 78.0 t -117.55 132.46 67.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-O 122.038 0.923 . . . . 0.0 113.257 -168.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.562 ' HB3' HG23 ' A' ' 71' ' ' ILE . 2.2 tt -81.14 123.49 28.47 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.274 171.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.588 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 5.6 mm -99.42 105.54 17.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 173.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.484 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 16.5 t70 -108.55 132.69 53.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.025 0.44 . . . . 0.0 111.582 -175.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.639 ' HB3' HD21 ' A' ' 114' ' ' LEU . 62.8 m-85 -121.64 109.82 15.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.529 174.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 t -150.06 176.82 10.45 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.695 HG23 ' HB2' ' A' ' 47' ' ' ASN . 17.8 m -119.59 113.27 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.64 175.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.812 ' CD1' ' HB2' ' A' ' 75' ' ' SER . 33.6 m-85 -67.72 84.77 0.2 Allowed 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.673 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 57.2 t30 174.04 -35.65 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.098 0.951 . . . . 0.0 109.228 -172.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.695 ' HB2' HG23 ' A' ' 44' ' ' VAL . 9.4 t-20 -85.07 143.09 29.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.265 -172.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.55 69.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.367 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.8 mtp -65.56 -24.33 67.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.184 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -81.47 -23.87 37.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.562 -176.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.58 -56.9 14.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.844 0.354 . . . . 0.0 110.827 -178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.78 -27.46 65.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.597 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.6 t60 -66.7 -45.64 78.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.614 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.503 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.4 m-20 -67.05 -27.91 67.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.23 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -61.13 -56.22 23.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.133 0.492 . . . . 0.0 109.896 176.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.43 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . -59.43 -33.38 71.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.021 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 96.3 mt -63.34 -40.8 98.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 110.136 176.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.865 HH21 ' HD3' ' A' ' 91' ' ' PRO . 14.5 ttm180 -64.89 -29.94 70.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.048 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -74.01 -51.82 14.69 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.473 ' CD1' ' HB3' ' A' ' 136' ' ' LEU . 22.7 mt -55.71 -35.91 66.6 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 111.742 -2.481 . . . . 0.0 111.336 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -73.02 -48.36 36.93 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.684 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -62.56 -22.35 66.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.637 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -79.32 -57.65 3.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.135 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.466 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 84.7 m-85 -112.6 -8.68 13.81 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -164.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.568 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.48 -43.0 83.74 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -173.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.4 m -67.84 -16.23 64.0 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.755 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.466 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.1 mp0 -93.88 -0.53 55.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 110.736 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.69 50.6 0.52 Allowed Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.498 -0.858 . . . . 0.0 111.814 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.568 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 80.8 t80 -130.45 136.14 48.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.122 0.487 . . . . 0.0 110.749 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.735 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.5 tp10 -135.7 159.94 40.08 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.461 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 39' ' ' LEU . 48.5 mt -131.0 130.15 63.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.007 0.432 . . . . 0.0 110.231 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.842 ' HB2' HD21 ' A' ' 33' ' ' LEU . 77.1 t80 -117.79 101.17 8.1 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.484 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 57.8 tt0 -105.8 121.52 44.21 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.303 -172.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.426 HD11 ' HE2' ' A' ' 72' ' ' TYR . 60.0 mt -101.88 130.31 51.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.421 -178.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.812 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 35.7 t -102.99 112.33 25.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.128 172.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.809 HD11 HD22 ' A' ' 114' ' ' LEU . 2.3 pp -113.22 28.47 8.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.89 0.376 . . . . 0.0 111.201 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.547 ' HB2' ' HB ' ' A' ' 44' ' ' VAL . 19.0 t70 -65.89 -73.91 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.319 176.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.35 -27.58 1.68 Allowed Glycine 0 N--CA 1.44 -1.041 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.892 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -85.67 131.34 34.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.24 0.543 . . . . 0.0 111.572 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -79.14 -38.97 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.52 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -68.96 -39.97 79.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.858 -165.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -77.97 -34.73 50.84 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 -176.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.598 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 22.7 t90 -62.19 -57.6 10.89 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.604 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -64.54 -38.91 92.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.928 -0.309 . . . . 0.0 111.691 -171.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -67.18 -43.53 81.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.999 0.428 . . . . 0.0 110.977 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.566 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.9 m -70.55 -24.37 62.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.811 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.775 ' HB1' HD11 ' A' ' 23' ' ' LEU . . . -87.8 -25.66 23.24 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.506 0.669 . . . . 0.0 110.099 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.3 -13.63 62.24 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.572 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -103.36 -3.49 25.45 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.832 174.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 86' ' ' SER . 41.4 mt -94.03 148.94 36.1 Favored Pre-proline 0 N--CA 1.447 -0.622 0 CA-C-O 121.361 0.6 . . . . 0.0 111.649 -175.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.865 ' HD3' HH21 ' A' ' 58' ' ' ARG . 24.7 Cg_endo -90.54 -37.95 0.05 OUTLIER 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 124.156 3.237 . . . . 0.0 113.875 -173.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.653 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.8 p90 -87.57 -169.05 2.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.206 -171.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.557 HG13 ' HG3' ' A' ' 28' ' ' ARG . 38.0 t -78.89 99.39 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-O 121.087 0.47 . . . . 0.0 110.112 -173.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.599 ' HB2' HD11 ' A' ' 23' ' ' LEU . 22.1 m -97.57 113.19 24.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.603 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.62 HG21 ' CE1' ' A' ' 72' ' ' TYR . 1.9 t -119.45 153.19 22.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.511 -170.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.463 ' HB2' ' CE2' ' A' ' 83' ' ' TRP . 7.8 tmm_? -124.02 140.0 53.4 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.456 ' HA ' HD13 ' A' ' 20' ' ' LEU . 16.1 t70 -81.92 158.61 23.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 -173.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.36 -34.53 31.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.028 -175.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.32 -12.66 8.59 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.159 -174.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 80.27 -120.17 5.12 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.688 175.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.09 -6.17 32.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 111.55 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -104.15 16.97 25.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.133 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.486 ' HB3' HG13 ' A' ' 106' ' ' ILE . 24.2 t -65.08 133.1 50.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.49 -178.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.484 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 12.0 m -62.53 -26.91 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.186 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.459 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 88.5 m-85 -63.53 -42.63 98.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.982 0.42 . . . . 0.0 110.019 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.654 HD11 HD22 ' A' ' 76' ' ' LEU . 52.3 mt -52.94 -42.27 43.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.999 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.8 m -71.93 -20.39 61.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.341 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 104' ' ' SER . 97.6 mt -81.2 -38.48 26.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.661 0.267 . . . . 0.0 111.406 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.459 ' HE2' ' HB3' ' A' ' 105' ' ' TYR . 77.3 m-85 -79.55 -25.21 41.72 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.882 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.809 HD22 HD11 ' A' ' 76' ' ' LEU . 2.4 mp . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 111.473 0.175 . . . . 0.0 111.473 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.519 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 3.9 Cg_exo -72.38 166.86 79.03 Favored 'Cis proline' 0 C--N 1.353 0.801 0 C-N-CA 123.712 -1.37 . . . . 0.0 111.914 -0.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.4 m -145.17 157.32 44.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.89 -177.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.548 ' O ' ' HA3' ' A' ' 130' ' ' GLY . 1.3 p -134.98 155.43 38.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.588 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 89.7 m-85 -145.56 153.57 41.23 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.856 ' HB3' ' HB3' ' A' ' 127' ' ' SER . 8.5 tp -122.07 150.35 42.26 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.488 -1.285 . . . . 0.0 112.217 -178.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.58 HG12 ' HA ' ' A' ' 126' ' ' LEU . 13.7 m -136.93 143.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.749 169.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.582 ' HB3' HD22 ' A' ' 143' ' ' LEU . 5.0 p30 -110.48 153.79 24.55 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.748 ' H ' HG22 ' A' ' 37' ' ' VAL . 21.4 ttp-105 49.8 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.785 1.303 . . . . 0.0 113.173 167.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.401 ' H ' ' HB3' ' A' ' 122' ' ' ARG . 9.4 m120 -97.56 30.54 2.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.768 -176.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.567 ' CB ' ' HG3' ' A' ' 34' ' ' LYS . 1.2 t-20 58.68 53.88 5.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.998 -178.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.569 ' HG3' ' ND2' ' A' ' 121' ' ' ASN . 1.6 pt-20 -109.08 128.73 55.24 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.379 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.58 ' HA ' HG12 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -52.07 116.4 2.17 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.688 0.618 . . . . 0.0 111.192 -173.619 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.856 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 24.8 t -71.76 -61.56 1.74 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.663 178.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.11 164.34 18.04 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.771 179.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.553 ' HB3' ' OE1' ' A' ' 131' ' ' GLU . 7.3 mmm180 -75.37 147.5 39.98 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 1.048 ' HA2' HG12 ' A' ' 133' ' ' ILE . . . -67.33 -21.74 72.43 Favored Glycine 0 CA--C 1.508 -0.385 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.985 -175.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.553 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.9 mp0 -67.1 -12.39 59.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.361 0.601 . . . . 0.0 109.547 173.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -117.62 -1.53 11.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.163 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 1.048 HG12 ' HA2' ' A' ' 130' ' ' GLY . 16.5 mm -84.39 94.79 3.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.411 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 14.7 ptmm? -50.27 -51.78 41.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.383 0.611 . . . . 0.0 110.206 176.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.411 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 4.8 m-20 -144.35 126.64 15.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.927 HD22 HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.85 -38.86 79.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.412 ' HB2' HD21 ' A' ' 60' ' ' LEU . 9.5 t70 -49.09 -58.42 4.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.771 176.064 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.01 -40.96 70.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.414 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.616 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.914 -175.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.705 HD11 HD12 ' A' ' 136' ' ' LEU . 24.1 mt -60.64 -46.08 96.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.691 0.758 . . . . 0.0 110.037 176.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.447 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 17.2 ttpt -56.99 -39.09 74.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.559 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.569 ' HE3' ' HA ' ' A' ' 139' ' ' ALA . 17.9 pttp -84.39 -19.94 32.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.526 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 13.8 mt -81.52 -29.56 33.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -175.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 87.0 mt . . . . . 0 C--N 1.32 -0.695 0 CA-C-O 121.356 0.598 . . . . 0.0 110.179 178.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.579 HG21 ' O ' ' A' ' 124' ' ' ASN . 9.0 pt . . . . . 0 N--CA 1.449 -0.481 0 CA-C-O 120.81 0.338 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.443 HG21 ' HD1' ' A' ' 105' ' ' TYR . 63.9 mt -111.2 104.59 17.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.1 107.38 8.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.475 0.655 . . . . 0.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.605 ' O ' ' HA ' ' A' ' 29' ' ' SER . 28.4 mm -83.38 126.0 40.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.622 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.639 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 38.5 mt-30 -129.45 95.27 3.97 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.822 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.559 HD22 ' C ' ' A' ' 19' ' ' GLN . 1.1 mm? -129.58 159.95 34.79 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.5 mtmt -85.68 143.8 28.18 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.093 0.473 . . . . 0.0 110.453 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.506 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 23.2 p30 -80.72 -171.13 2.97 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.457 -178.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.656 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 3.3 tm? -50.51 -41.27 53.3 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.187 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.428 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 74.1 mmtt -75.73 -41.63 52.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.986 0.422 . . . . 0.0 110.977 -179.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 15.65 2.42 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.645 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.454 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 26.3 m-80 -87.92 118.05 27.2 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.8 m -64.59 107.52 1.42 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.201 0.524 . . . . 0.0 110.032 177.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.639 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 9.4 mmt180 -92.26 135.41 34.03 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.505 176.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.605 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 69.8 p -112.78 158.23 20.37 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 169.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.455 HD22 HG11 ' A' ' 38' ' ' VAL . 81.9 mt -68.1 -28.43 67.34 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.603 ' HA ' ' OD1' ' A' ' 124' ' ' ASN . 5.8 p -66.56 -17.14 64.65 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.037 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -81.85 -23.14 36.58 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.846 0.831 . . . . 0.0 109.171 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.62 HD23 HG13 ' A' ' 38' ' ' VAL . 2.4 tp -96.57 2.1 51.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.119 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -57.23 112.69 1.45 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.961 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.2 -41.97 1.12 Allowed Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 60.7 mttp -100.53 171.04 7.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.675 HG23 ' HD1' ' A' ' 69' ' ' PHE . 11.5 m -81.92 124.65 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 170.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.62 HG13 HD23 ' A' ' 33' ' ' LEU . 47.5 t -101.64 120.06 50.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.743 -170.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.582 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.5 tp -85.94 110.1 19.21 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.622 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 26.8 mm -84.38 105.12 13.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.509 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 10.3 t70 -108.52 110.65 22.2 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.68 -177.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.576 ' HB3' HD13 ' A' ' 114' ' ' LEU . 26.3 m-85 -98.23 100.31 11.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.781 174.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.485 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -136.27 -174.78 3.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.472 -176.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.635 ' CG1' ' HB3' ' A' ' 47' ' ' ASN . 12.0 p -133.18 133.03 58.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 177.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 1.026 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 42.4 m-85 -87.67 78.83 8.4 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -176.25 -38.55 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.849 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.635 ' HB3' ' CG1' ' A' ' 44' ' ' VAL . 5.0 t30 -90.07 133.24 34.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.519 -174.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.49 -22.39 32.33 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.987 -173.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.7 mtt -56.86 -30.36 63.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.868 0.366 . . . . 0.0 110.85 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.0 t -73.06 -23.03 60.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.949 -177.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.7 -58.78 5.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.797 0.332 . . . . 0.0 111.167 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.61 -31.42 68.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.26 0.552 . . . . 0.0 110.457 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.428 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.3 t60 -60.01 -41.7 92.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.726 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.6 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.2 m-20 -71.29 -20.91 62.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.795 -179.101 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.7 tt -72.47 -43.32 63.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.93 -37.35 82.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.384 0.612 . . . . 0.0 110.041 175.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 54' ' ' ASN . 91.0 mt -65.19 -41.43 94.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.805 176.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -57.49 -32.06 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.84 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.68 -55.44 5.65 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.795 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.61 -32.41 63.08 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.757 -2.019 . . . . 0.0 111.23 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -74.47 -47.86 30.87 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.223 0.535 . . . . 0.0 109.852 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.65 -20.75 66.48 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.685 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -78.82 -60.46 2.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.989 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.524 ' HB3' HD11 ' A' ' 144' ' ' LEU . 92.3 m-85 -114.29 -5.93 12.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 113.939 1.089 . . . . 0.0 113.939 -164.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.55 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -55.36 -38.05 68.31 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.299 0.499 . . . . 0.0 111.964 -175.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.2 p -66.65 -16.38 64.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.031 -176.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.483 ' HB2' HD13 ' A' ' 144' ' ' LEU . 3.6 mm-40 -96.65 4.45 51.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.793 0.33 . . . . 0.0 110.758 -174.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.87 45.78 1.25 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.622 -176.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.675 ' HD1' HG23 ' A' ' 37' ' ' VAL . 41.9 t80 -125.96 135.34 51.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.748 0.309 . . . . 0.0 110.3 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -140.43 147.5 39.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.971 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' A' ' 92' ' ' TRP . 55.8 mt -107.97 129.91 61.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.044 0.45 . . . . 0.0 110.082 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.417 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 83.1 t80 -110.8 99.83 8.68 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.509 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 19.3 tt0 -100.59 123.3 44.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.929 -173.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.407 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 27.6 mt -110.38 127.22 67.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.302 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 1.026 ' HB3' ' HD1' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -84.97 141.52 30.29 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.177 0.298 . . . . 0.0 110.301 172.3 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.534 HD11 ' CD1' ' A' ' 114' ' ' LEU . 47.3 mt -96.0 -3.46 44.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 111.058 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.457 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 5.8 p-10 -90.36 -170.57 2.79 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.433 -174.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -136.47 29.18 2.81 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 173.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.33 125.88 41.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.882 0.372 . . . . 0.0 110.237 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.2 -43.87 23.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.66 -177.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.7 p80 -69.05 -42.95 75.61 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.162 -166.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -79.12 -38.23 36.63 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.278 -177.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.656 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 31.5 t90 -61.64 -51.25 69.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.06 0.457 . . . . 0.0 109.979 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.615 ' HA ' HD21 ' A' ' 23' ' ' LEU . 50.2 tttm -63.08 -52.85 61.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.219 -175.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.7 m -59.1 -35.17 72.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.995 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.477 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 24.2 t -85.17 -43.29 13.96 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.262 -178.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.601 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -80.67 -25.1 38.45 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -171.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -57.9 -31.86 67.16 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.824 0.345 . . . . 0.0 111.837 -175.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -109.29 13.98 24.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.467 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.496 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 17.9 mt -76.95 148.71 79.22 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.281 0.562 . . . . 0.0 111.937 -177.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.69 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -73.21 -41.5 1.26 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.648 2.899 . . . . 0.0 113.233 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.69 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.1 p90 -95.35 -171.72 2.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.837 0.351 . . . . 0.0 111.466 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.8 t -82.94 132.99 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.152 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.601 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 3.9 p -130.93 110.6 11.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -176.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.506 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 15.6 m -123.53 162.02 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.421 ' O ' HD12 ' A' ' 20' ' ' LEU . 52.4 ttp180 -124.03 129.87 51.63 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.136 -0.625 . . . . 0.0 112.271 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -106.5 111.29 23.78 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 171.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -71.22 -2.19 15.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.964 0.411 . . . . 0.0 111.318 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -103.35 10.05 37.63 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.23 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.505 ' HA3' ' HB3' ' A' ' 76' ' ' LEU . . . -64.26 76.14 0.06 OUTLIER Glycine 0 CA--C 1.522 0.521 0 N-CA-C 114.425 0.53 . . . . 0.0 114.425 -173.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 168.54 -29.74 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.649 1.18 . . . . 0.0 107.974 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -126.2 14.4 7.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.946 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.525 ' HB3' HG13 ' A' ' 106' ' ' ILE . 7.4 t -70.12 135.18 48.93 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.635 -171.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.463 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 1.4 m -54.11 -33.4 57.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.03 -177.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.502 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 29.8 m-85 -68.67 -44.45 74.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.25 -175.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.525 HG13 ' HB3' ' A' ' 103' ' ' SER . 66.3 mt -53.25 -46.34 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.837 -173.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 11.2 m -67.84 -31.12 70.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.95 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.0 mt -70.28 -26.83 63.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 0.0 110.751 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.616 ' O ' ' HB3' ' A' ' 110' ' ' ASN . 84.0 m-85 -81.8 -2.68 51.71 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.121 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.616 ' HB3' ' O ' ' A' ' 109' ' ' TYR . 3.2 t30 . . . . . 0 N--CA 1.477 0.92 0 O-C-N 124.039 0.837 . . . . 0.0 109.788 -177.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.743 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 88.6 mt . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.743 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.0 Cg_endo -70.84 156.47 95.71 Favored 'Cis proline' 0 C--N 1.362 1.249 0 CA-C-N 120.77 1.311 . . . . 0.0 114.028 1.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 69.1 m -156.88 146.38 20.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.83 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.497 HG12 ' HA3' ' A' ' 130' ' ' GLY . 3.3 p -103.91 156.93 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.622 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 77.0 m-85 -141.09 164.97 28.84 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.967 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 10.7 tp -111.73 138.53 48.18 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.531 -175.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.465 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 4.9 t -131.13 117.79 38.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.22 0.533 . . . . 0.0 110.005 171.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -69.15 161.39 29.21 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.635 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.543 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 25.3 mtm180 -53.94 -20.69 6.49 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -171.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.526 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 56.0 t30 -83.46 5.09 25.01 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.603 ' OD1' ' HA ' ' A' ' 31' ' ' THR . 1.4 m120 63.64 60.68 1.07 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.664 -167.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.532 ' HA ' HG21 ' A' ' 15' ' ' ILE . 56.3 mt-10 -126.2 118.15 24.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.352 179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.462 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.9 OUTLIER -57.58 109.04 0.63 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.392 0.615 . . . . 0.0 109.36 176.368 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.967 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -82.43 -48.59 10.92 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.486 -172.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -175.7 172.93 2.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.286 -178.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.575 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 78.7 mtt85 -90.89 156.65 17.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.074 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.497 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -59.33 -38.58 93.55 Favored Glycine 0 C--O 1.228 -0.221 0 C-N-CA 121.521 -0.371 . . . . 0.0 112.567 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.575 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.2 OUTLIER -79.46 -19.21 50.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.46 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.532 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -86.59 -19.58 29.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.511 0.672 . . . . 0.0 109.498 179.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.505 HD11 ' HB2' ' A' ' 119' ' ' LEU . 83.2 mt -92.28 123.27 44.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.562 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -57.12 -45.09 83.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.692 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.593 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 2.4 p-10 -156.61 128.66 7.36 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.565 ' O ' HG13 ' A' ' 140' ' ' ILE . 6.8 mp -75.31 -25.87 58.21 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.594 -174.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.518 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.0 t70 -50.74 -58.38 6.05 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 123.475 0.485 . . . . 0.0 109.931 174.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.593 ' HB2' ' OD2' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -55.96 -41.69 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.12 175.888 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.402 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -65.32 -52.61 52.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.82 -175.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.795 HD12 HD12 ' A' ' 60' ' ' LEU . 45.8 mt -59.96 -42.34 89.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.61 0.719 . . . . 0.0 109.878 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.9 ttpt -57.58 -40.03 78.1 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.331 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -84.67 -24.67 28.9 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.945 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 30.8 mt -66.45 -40.72 89.59 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-O 120.958 0.409 . . . . 0.0 110.164 175.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 64' ' ' TYR . 95.9 mt . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.948 179.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 tp . . . . . 0 N--CA 1.448 -0.569 0 CA-C-O 121.591 0.71 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.765 ' H ' HD13 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -90.18 136.26 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.582 177.881 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -104.7 107.61 18.65 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.61 ' O ' ' HA ' ' A' ' 29' ' ' SER . 33.8 mt -92.47 110.53 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.252 -175.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -108.63 100.64 9.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.131 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.717 ' HB2' HG11 ' A' ' 95' ' ' VAL . 39.1 mt -139.33 166.4 24.64 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.685 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 34.2 mttm -96.5 150.26 20.82 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 121.129 0.49 . . . . 0.0 110.988 177.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.4 OUTLIER -82.55 -171.88 3.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.192 179.104 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 1.039 HD13 ' HA ' ' A' ' 88' ' ' ASP . 1.0 OUTLIER -49.28 -44.74 44.24 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.807 177.991 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -79.83 -20.41 46.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.011 -176.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.61 7.92 27.19 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.059 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -82.58 113.31 20.21 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.965 0.412 . . . . 0.0 110.377 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.685 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 24.9 m -69.76 119.86 14.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.542 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 14.8 mmm180 -110.27 138.67 46.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.773 177.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.61 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 12.0 p -119.39 164.27 15.97 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 174.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.548 HD22 HG11 ' A' ' 38' ' ' VAL . 33.5 mt -80.3 -34.03 37.14 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.415 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.5 p -65.05 -16.78 63.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.226 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -78.2 -37.49 45.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.865 0.841 . . . . 0.0 109.082 177.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.478 HD23 HG13 ' A' ' 38' ' ' VAL . 3.7 tp -81.44 5.65 16.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.487 -1.233 . . . . 0.0 111.427 -173.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -62.83 114.73 3.81 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.126 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.71 -39.74 1.0 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 -174.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.638 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 84.6 mttt -104.15 170.89 7.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 172.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.795 HG23 ' HD1' ' A' ' 69' ' ' PHE . 15.8 m -83.57 125.95 40.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 168.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.548 HG11 HD22 ' A' ' 30' ' ' LEU . 59.8 t -101.64 123.74 54.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.312 0.577 . . . . 0.0 111.664 -168.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 39' ' ' LEU . 12.4 tp -89.25 121.27 31.38 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.113 172.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.588 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -97.91 105.13 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.457 177.812 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.604 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 12.7 t70 -102.36 128.68 48.83 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.411 -177.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -121.77 97.7 5.61 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 176.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.803 ' O ' ' HA ' ' A' ' 75' ' ' SER . 31.1 m -138.66 147.41 42.81 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.758 -170.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.575 HG12 ' HG ' ' A' ' 76' ' ' LEU . 29.7 m -96.04 119.54 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 121.315 0.578 . . . . 0.0 109.998 173.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.528 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 5.5 m-85 -73.01 85.34 1.29 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.97 177.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 t30 173.94 -36.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.638 -172.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -74.04 150.87 40.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.613 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.89 -29.67 68.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -173.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.3 mtt -66.75 -20.48 65.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.601 0.239 . . . . 0.0 110.504 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.1 t -58.67 -29.17 66.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.109 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.63 -55.2 21.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.89 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.66 -30.86 64.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.53 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 82.5 t60 -69.49 -37.53 77.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -63.29 -38.62 91.88 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.282 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.13 -52.02 65.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.15 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.53 90.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.137 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 89.7 mt -62.9 -42.07 99.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.2 0.524 . . . . 0.0 109.912 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.84 -31.75 71.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.919 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.429 ' HG2' ' HE3' ' A' ' 63' ' ' LYS . 7.7 tt0 -75.94 -56.15 4.94 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 -172.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.833 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -54.69 -32.2 59.08 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.417 -2.174 . . . . 0.0 111.289 178.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -77.96 -50.62 11.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.139 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.412 HD22 ' N ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -65.14 -21.78 66.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.045 0.45 . . . . 0.0 110.865 -176.871 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HE3' ' HG2' ' A' ' 59' ' ' GLU . 89.8 mttt -77.3 -55.08 5.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.113 177.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.576 ' HB3' HD11 ' A' ' 144' ' ' LEU . 94.0 m-85 -113.79 -9.26 13.14 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -164.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.567 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -54.56 -43.34 71.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.403 ' HB2' ' OE1' ' A' ' 67' ' ' GLN . 12.2 m -67.77 -18.62 64.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.824 -175.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.437 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 0.9 OUTLIER -95.45 4.8 52.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.811 -179.108 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.59 51.57 0.7 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.637 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.795 ' HD1' HG23 ' A' ' 37' ' ' VAL . 56.6 t80 -127.85 143.07 51.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.615 0.245 . . . . 0.0 110.386 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.638 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.38 147.63 38.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.134 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.464 HD12 ' CE3' ' A' ' 92' ' ' TRP . 68.3 mt -112.96 117.77 56.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.156 0.503 . . . . 0.0 110.09 175.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.524 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 81.0 t80 -100.74 99.93 10.54 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 175.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.604 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 12.0 tm0? -91.12 143.37 26.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.828 -173.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.425 HD11 ' HE2' ' A' ' 72' ' ' TYR . 65.5 mt -136.86 121.61 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.803 ' HA ' ' O ' ' A' ' 43' ' ' THR . 89.3 p -99.99 121.13 40.88 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 121.524 0.678 . . . . 0.0 110.973 177.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.6 HD13 HD11 ' A' ' 106' ' ' ILE . 0.6 OUTLIER -101.56 43.29 1.07 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -77.48 -169.76 1.55 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.326 -1.306 . . . . 0.0 111.648 -174.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -129.18 21.39 5.2 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.603 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.413 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 28.0 t70 -162.64 115.14 1.63 Allowed 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.304 0.573 . . . . 0.0 110.236 -177.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.553 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 18.1 tt0 -77.35 -14.33 59.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.157 -176.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . 0.413 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 56.3 m80 -68.68 -56.85 6.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.793 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -60.61 -47.86 84.35 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 120.859 0.362 . . . . 0.0 110.067 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.528 ' CH2' ' HB2' ' A' ' 96' ' ' ARG . 39.5 t90 -55.51 -52.45 63.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.506 179.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.553 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 24.9 ttmt -65.8 -47.77 73.98 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.421 -174.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.8 p -62.98 -34.96 78.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.03 0.443 . . . . 0.0 111.317 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.1 m -78.43 -48.5 15.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.452 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.82 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -88.79 -21.05 23.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -168.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 1.039 ' HA ' HD13 ' A' ' 23' ' ' LEU . 28.2 t70 -57.93 -31.12 66.51 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -168.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -101.58 16.22 26.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.34 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.572 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 25.9 mt -81.25 157.65 70.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.09 0.472 . . . . 0.0 111.745 -178.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.628 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 56.1 Cg_endo -64.24 -52.15 1.72 Allowed 'Trans proline' 0 N--CA 1.477 0.536 0 C-N-CA 124.148 3.232 . . . . 0.0 113.575 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.628 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 13.1 p90 -89.55 179.02 6.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.227 0.537 . . . . 0.0 111.668 -173.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.542 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 48.4 t -76.48 123.68 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.102 -176.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.773 ' HB2' HD11 ' A' ' 23' ' ' LEU . 62.5 m -116.98 109.08 16.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.126 0.488 . . . . 0.0 110.131 -178.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.717 HG11 ' HB2' ' A' ' 20' ' ' LEU . 11.1 t -114.73 159.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.304 -172.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.528 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 31.3 ttt180 -122.02 142.15 50.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.737 0.303 . . . . 0.0 110.579 179.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -83.6 142.72 30.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.19 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.38 -5.58 58.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -172.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 12.7 m120 -119.95 -13.73 9.0 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.051 -0.66 . . . . 0.0 112.568 -175.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 57.24 82.71 0.05 OUTLIER Glycine 0 CA--C 1.522 0.525 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.339 174.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.555 ' H ' ' HB2' ' A' ' 76' ' ' LEU . . . 74.35 -29.06 0.19 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.436 0.694 . . . . 0.0 111.556 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -85.38 21.57 1.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.537 ' HB3' HG13 ' A' ' 106' ' ' ILE . 38.3 t -61.56 144.51 54.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.811 -173.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.552 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 15.9 m -72.75 -29.89 63.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.741 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.413 ' HA ' HD12 ' A' ' 108' ' ' LEU . 88.2 m-85 -68.71 -40.7 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.445 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.6 HD11 HD13 ' A' ' 76' ' ' LEU . 74.2 mt -55.49 -34.3 34.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.834 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.5 m -80.44 -27.14 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.0 mt -68.55 -42.09 78.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.268 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.575 ' OH ' HG13 ' A' ' 16' ' ' ILE . 37.2 m-85 -80.58 -20.4 43.43 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.501 178.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.55 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER . . . . . 0 CA--C 1.514 -0.435 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -169.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.466 ' HG ' ' CD1' ' A' ' 76' ' ' LEU . 3.9 mm? . . . . . 0 C--O 1.234 0.268 0 N-CA-C 110.651 -0.129 . . . . 0.0 110.651 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.488 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 12.5 Cg_exo -73.42 156.02 99.65 Favored 'Cis proline' 0 C--N 1.349 0.57 0 C-N-CA 123.69 -1.379 . . . . 0.0 112.418 -0.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.5 m -140.26 170.08 16.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.286 -177.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.35 155.75 16.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.836 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.588 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 90.2 m-85 -138.1 157.73 45.75 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.697 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -111.46 141.85 44.49 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -177.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.532 HG23 HD11 ' A' ' 40' ' ' ILE . 6.8 t -138.7 129.4 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 174.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.639 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 4.6 p30 -85.45 170.61 12.51 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.063 178.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.531 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 13.4 ptt180 -52.72 -23.2 6.26 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -170.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -81.61 3.29 25.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.733 0.302 . . . . 0.0 110.24 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.411 HD22 ' HA ' ' A' ' 124' ' ' ASN . 2.1 t-20 65.93 53.28 1.13 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.598 -171.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.639 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 41.3 mt-10 -124.73 137.66 54.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.916 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 4.2 tt -68.18 109.31 3.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.318 0.58 . . . . 0.0 109.606 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.697 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 23.4 m -71.55 -57.84 4.04 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.237 -177.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.01 171.83 15.93 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.78 -175.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.584 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -98.75 146.06 26.29 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.783 -178.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -50.39 -26.69 10.09 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 121.528 -0.367 . . . . 0.0 113.041 178.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.77 -44.06 94.53 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.978 0.511 . . . . 0.0 111.592 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -104.51 -6.63 20.44 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -170.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.783 HG21 ' HG ' ' A' ' 136' ' ' LEU . 80.2 mt -76.57 100.44 2.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.193 0.52 . . . . 0.0 109.855 175.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.55 -50.07 75.0 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.044 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -139.59 109.07 6.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.978 -177.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.783 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.7 mp -70.46 -37.4 74.29 Favored 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.424 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.455 ' HA ' HD11 ' A' ' 60' ' ' LEU . 9.6 t70 -53.2 -52.33 59.21 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.591 177.051 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -64.16 -41.55 97.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.276 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.682 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -62.99 -50.73 69.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.853 -176.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.833 HD12 HD12 ' A' ' 60' ' ' LEU . 43.1 mt -61.15 -37.03 76.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.377 0.608 . . . . 0.0 110.272 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -61.94 -41.23 97.73 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.278 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.682 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -81.4 -19.51 42.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 111.193 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 75.4 mt -74.29 -39.54 62.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.809 176.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.576 HD11 ' HB3' ' A' ' 64' ' ' TYR . 65.4 mt . . . . . 0 C--N 1.326 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.423 -177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.847 HG21 ' H ' ' A' ' 126' ' ' LEU . 34.5 pt . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.435 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.0 mp -86.41 89.71 2.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.86 115.43 9.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.694 174.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.502 HD11 ' OH ' ' A' ' 109' ' ' TYR . 7.0 mt -104.26 122.11 56.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.837 -177.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.636 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 2.2 mp0 -112.71 100.5 8.75 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.198 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.43 ' HG ' HG22 ' A' ' 18' ' ' ILE . 71.1 mt -132.81 156.19 47.58 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 97.1 mttt -82.3 138.02 34.67 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.886 0.374 . . . . 0.0 111.465 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -88.96 -167.66 1.95 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.87 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.593 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 55.4 tp -50.39 -36.86 34.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.77 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -77.74 -10.09 59.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.967 0.413 . . . . 0.0 111.805 -178.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.77 18.17 60.37 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.492 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.9 OUTLIER -100.55 123.57 44.94 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.226 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.631 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 4.7 m -64.48 115.63 5.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.468 0.651 . . . . 0.0 111.367 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.636 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.6 mmm180 -88.06 142.67 27.59 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.851 172.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.63 ' CB ' ' HG3' ' A' ' 19' ' ' GLN . 1.5 m -124.01 138.56 54.44 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.543 HD22 HG11 ' A' ' 38' ' ' VAL . 50.5 mt -63.82 -32.92 74.59 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.026 178.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.8 0.05 14.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.258 177.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -105.27 -41.95 5.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.531 0.682 . . . . 0.0 109.339 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.47 ' CD1' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -78.83 -0.16 29.48 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.427 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.517 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 24.6 ttpp -63.09 102.87 0.41 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.714 176.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.86 -30.49 0.21 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -175.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.556 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -113.63 174.2 6.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 167.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.446 HG23 ' HD1' ' A' ' 69' ' ' PHE . 21.3 m -80.93 129.26 37.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.649 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 47.6 t -101.0 116.3 44.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.193 0.52 . . . . 0.0 110.812 -171.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.568 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 14.1 tp -82.84 111.75 19.03 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.622 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 27.4 mm -83.98 105.29 13.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.593 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 16.2 t70 -108.62 130.08 55.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.791 -178.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.585 ' HB3' HD21 ' A' ' 114' ' ' LEU . 51.5 m-85 -117.69 116.25 26.68 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 173.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.571 ' O ' ' HA ' ' A' ' 75' ' ' SER . 14.7 t -149.36 -176.44 5.38 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 -178.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.654 HG13 ' HB2' ' A' ' 47' ' ' ASN . 1.7 p -131.95 117.89 35.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 176.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.575 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 28.2 m-85 -77.42 79.33 3.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 122.173 0.987 . . . . 0.0 109.329 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.521 ' HB3' HG22 ' A' ' 44' ' ' VAL . 21.3 t-20 178.1 -27.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.208 -1.815 . . . . 0.0 109.297 -177.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.654 ' HB2' HG13 ' A' ' 44' ' ' VAL . 25.3 t-20 -86.16 141.09 29.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.72 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -25.8 66.6 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.163 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 94.5 mmm -68.43 -17.41 64.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.528 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.8 t -71.99 -28.48 63.44 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.64 -55.14 38.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.23 -26.39 63.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.245 0.545 . . . . 0.0 110.831 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.437 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 83.6 t60 -70.21 -45.52 66.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.524 -179.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.592 ' HA ' HD12 ' A' ' 57' ' ' LEU . 8.0 m120 -64.31 -28.05 69.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.986 178.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -62.8 -55.09 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.609 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.37 74.82 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.592 HD12 ' HA ' ' A' ' 54' ' ' ASN . 90.2 mt -63.56 -41.09 98.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.067 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -61.95 -30.32 70.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.092 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.32 -51.86 12.2 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -174.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 140' ' ' ILE . 2.4 mm? -58.05 -29.99 65.8 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 112.673 -2.058 . . . . 0.0 111.299 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -78.68 -50.35 11.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.028 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -60.6 -21.95 63.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.202 0.525 . . . . 0.0 110.613 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -79.56 -57.1 3.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.412 177.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.671 ' HB3' HD11 ' A' ' 144' ' ' LEU . 91.3 m-85 -112.64 -8.65 13.79 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -165.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.554 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -68.99 169.83 11.0 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.115 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.3 m 70.06 -35.04 0.3 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.744 0.652 . . . . 0.0 110.799 -174.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.519 ' H ' ' C ' ' A' ' 65' ' ' ALA . 23.1 mt-30 -82.25 16.88 1.83 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.716 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.96 18.04 14.86 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.994 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.568 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 66.8 t80 -107.61 144.49 34.57 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.556 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 8.7 tp10 -145.06 156.09 43.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.463 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' A' ' 92' ' ' TRP . 48.3 mt -120.26 129.49 75.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.062 0.458 . . . . 0.0 110.001 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.448 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 78.5 t80 -117.8 101.01 7.96 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.405 178.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.593 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 39.2 mt-30 -92.74 144.15 25.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.473 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.5 mt -123.66 116.4 48.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.329 172.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.575 ' HB3' ' HD1' ' A' ' 45' ' ' TYR . 62.7 p -92.11 134.51 34.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.377 . . . . 0.0 110.993 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.6 HD12 HD22 ' A' ' 114' ' ' LEU . 50.2 mt -104.65 37.35 2.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.311 0.577 . . . . 0.0 109.623 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.524 ' HA ' HG23 ' A' ' 44' ' ' VAL . 3.5 p30 -87.38 172.05 10.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.861 -173.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -125.85 34.36 3.3 Favored Glycine 0 N--CA 1.442 -0.925 0 N-CA-C 110.056 -1.217 . . . . 0.0 110.056 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -149.55 101.92 3.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.17 0.51 . . . . 0.0 109.906 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -76.57 -25.71 54.3 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.654 -174.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -74.34 -30.38 62.0 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.234 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -76.14 -47.62 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.865 174.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.593 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 59.3 t90 -56.37 -42.02 77.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.632 176.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.539 ' HA ' ' CD1' ' A' ' 23' ' ' LEU . 22.5 ttmm -67.14 -51.78 49.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.315 -179.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 m -69.36 -22.0 63.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 0.0 111.402 -175.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.482 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 22.8 t -85.08 -35.12 22.04 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.262 . . . . 0.0 110.682 178.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.542 ' HA ' HD12 ' A' ' 90' ' ' LEU . . . -79.5 -17.93 53.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.658 -176.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -50.15 -45.74 53.45 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.53 0.519 . . . . 0.0 112.116 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -100.07 14.86 29.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.331 -176.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.542 HD12 ' HA ' ' A' ' 87' ' ' ALA . 22.5 mt -88.09 144.73 34.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.38 0.609 . . . . 0.0 111.923 -176.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.692 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 59.7 Cg_endo -80.89 -38.9 0.24 Allowed 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.828 3.019 . . . . 0.0 113.687 -176.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.692 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.2 p90 -101.17 -169.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.166 -171.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.51 HG11 ' HG3' ' A' ' 28' ' ' ARG . 46.7 t -91.93 131.42 39.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.791 0.329 . . . . 0.0 110.689 -172.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 85.4 m -130.31 114.91 16.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.284 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.605 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.4 m -115.97 165.74 10.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -121.92 144.51 48.82 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.349 -179.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -89.17 157.21 18.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.35 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.1 -33.39 29.77 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -174.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.59 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 53.7 t30 -118.13 -12.21 10.05 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.499 -171.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.9 -128.26 8.5 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.657 175.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.5 4.01 5.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.59 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 20.7 m-85 -111.69 13.02 21.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.97 0.414 . . . . 0.0 109.949 178.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.2 t -64.74 137.43 57.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.443 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 14.8 m -64.36 -24.24 67.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.018 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -61.08 -46.13 91.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.958 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.9 mt -61.54 -31.23 50.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.075 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 14.3 m -71.18 -23.05 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.349 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.33 -17.27 46.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.502 ' OH ' HD11 ' A' ' 18' ' ' ILE . 90.4 m-85 -89.49 -20.59 23.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.198 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 C--N 1.331 -0.239 0 CA-C-O 122.204 1.002 . . . . 0.0 108.708 -167.313 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.6 HD22 HD12 ' A' ' 76' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.373 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 27.4 Cg_endo -62.94 153.28 69.31 Favored 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.296 -1.127 . . . . 0.0 113.621 0.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.4 m -137.33 170.67 15.69 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.271 -177.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.5 p -142.44 153.69 18.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.622 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 64.1 m-85 -140.85 164.8 29.25 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 1.016 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 9.9 tp -110.7 134.5 52.4 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.649 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 10.3 t -125.93 117.25 48.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.421 0.629 . . . . 0.0 110.532 171.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.488 ' HA ' HD13 ' A' ' 143' ' ' LEU . 18.4 t30 -68.9 161.76 28.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.283 177.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -17.66 10.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -169.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -90.95 14.79 12.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.005 0.431 . . . . 0.0 110.17 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.517 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 1.0 OUTLIER 59.0 58.96 2.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.025 -175.182 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.502 ' HA ' HG21 ' A' ' 15' ' ' ILE . 32.5 mt-10 -124.22 123.77 40.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.054 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.847 ' H ' HG21 ' A' ' 15' ' ' ILE . 19.6 mt -56.52 107.21 0.36 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.417 0.627 . . . . 0.0 110.016 172.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 1.016 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 49.5 m -79.7 -42.47 24.6 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.681 -175.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 179.96 172.74 1.01 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.392 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.505 ' O ' HG13 ' A' ' 133' ' ' ILE . 86.7 mtm180 -103.59 159.25 15.76 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.909 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -47.23 -43.83 19.43 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 114.327 0.491 . . . . 0.0 114.327 -174.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -72.55 -29.68 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.095 0.474 . . . . 0.0 111.379 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.413 ' OD1' ' HB2' ' A' ' 129' ' ' ARG . 8.9 m120 -79.54 -26.44 41.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.829 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.862 HG21 ' HG ' ' A' ' 136' ' ' LEU . 78.3 mt -82.01 112.3 19.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.877 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.449 ' N ' ' HD2' ' A' ' 134' ' ' LYS . 3.3 mptp? -90.44 98.11 11.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.984 174.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.93 106.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.131 -176.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.862 ' HG ' HG21 ' A' ' 133' ' ' ILE . 6.0 mp -70.07 -25.37 63.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.518 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -50.59 -52.64 37.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.375 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.52 -44.14 95.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.046 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.472 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -57.83 -53.88 53.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.698 -176.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.843 HD12 HD12 ' A' ' 60' ' ' LEU . 42.4 mt -60.37 -39.96 82.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.007 0.432 . . . . 0.0 111.115 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 3.9 ttmp? -58.5 -44.36 89.39 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.744 -178.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -78.94 -24.45 43.96 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.769 -176.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 121' ' ' ASN . 27.5 mt -72.18 -38.14 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.24 0.543 . . . . 0.0 110.372 175.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.671 HD11 ' HB3' ' A' ' 64' ' ' TYR . 28.6 mt . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.001 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.699 HG21 ' O ' ' A' ' 124' ' ' ASN . 6.9 tt . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.502 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.9 mp -97.26 138.01 23.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -92.64 108.48 20.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.558 HD11 ' OH ' ' A' ' 109' ' ' TYR . 8.9 mt -89.47 115.4 29.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.352 -177.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -111.91 100.16 8.68 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.517 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.704 ' HB2' HG11 ' A' ' 95' ' ' VAL . 22.2 mt -136.08 162.42 32.96 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.636 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.1 mttm -90.83 147.47 23.16 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.67 0.747 . . . . 0.0 111.17 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.59 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.7 OUTLIER -84.27 -173.51 4.76 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.625 -174.036 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.86 HD11 ' HA ' ' A' ' 84' ' ' LYS . 15.0 tp -54.29 -42.73 70.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.616 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.509 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.02 -39.92 83.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.601 178.314 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.471 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 124.12 13.91 3.87 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.172 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.8 m-80 -96.7 125.44 41.16 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 122.818 -0.225 . . . . 0.0 110.536 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.636 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 7.8 m -63.33 113.6 3.32 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.407 0.622 . . . . 0.0 110.586 177.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.514 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 9.4 mmm180 -102.16 127.97 48.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.246 177.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 57.6 p -115.67 158.42 22.77 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 174.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.815 ' HB3' HD21 ' A' ' 124' ' ' ASN . 79.0 mt -74.07 -29.12 61.72 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.4 p -63.37 -22.6 66.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.569 175.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -91.13 -34.42 15.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.602 0.715 . . . . 0.0 109.724 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.681 HD11 ' HG2' ' A' ' 70' ' ' GLU . 11.9 tp -82.01 10.04 7.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.857 -177.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -64.18 -11.17 28.25 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.591 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.36 -18.46 65.38 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.1 -178.31 4.77 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.891 0.377 . . . . 0.0 110.266 177.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.674 HG23 ' HD1' ' A' ' 69' ' ' PHE . 16.6 m -85.36 126.83 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 168.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.529 HG11 HD22 ' A' ' 30' ' ' LEU . 38.7 t -101.04 129.18 52.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.27 0.557 . . . . 0.0 111.663 -167.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.761 HD11 HD21 ' A' ' 136' ' ' LEU . 12.4 tp -95.72 110.58 22.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.512 173.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.557 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.0 mm -84.77 105.78 14.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.5 ' HB3' ' NE2' ' A' ' 73' ' ' GLN . 5.6 t70 -114.04 129.82 56.59 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.898 -175.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -116.58 97.78 6.19 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.76 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 m -137.95 141.45 40.54 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.212 0.53 . . . . 0.0 111.518 -170.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.66 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.1 OUTLIER -95.63 118.22 41.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.018 -177.799 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -77.26 80.74 3.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.662 0.744 . . . . 0.0 109.708 174.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.479 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 19.7 t-20 174.35 -33.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.855 -176.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.66 ' HB2' HG13 ' A' ' 44' ' ' VAL . 8.0 t-20 -73.4 148.85 42.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.031 -176.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.43 -33.54 71.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.807 -178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.1 tpp -67.58 -26.79 66.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.061 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.7 m -60.99 -32.97 72.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.997 -175.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.69 95.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.842 0.353 . . . . 0.0 111.191 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.66 -29.49 45.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.098 0.475 . . . . 0.0 110.572 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.445 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 85.5 t60 -65.85 -42.41 90.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.819 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.401 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.5 m-20 -66.23 -21.44 66.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.591 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.2 tm? -64.14 -54.92 26.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.416 0.627 . . . . 0.0 109.91 176.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.18 -33.11 72.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.8 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 86.8 mt -65.15 -40.45 94.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.804 176.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.451 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.1 tpt180 -59.28 -33.51 71.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.778 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.81 -55.1 6.18 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -172.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.81 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.2 -31.91 61.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 112.846 -1.979 . . . . 0.0 111.624 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.404 ' HD1' HG13 ' A' ' 71' ' ' ILE . 24.9 t80 -77.97 -48.8 15.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.978 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.406 ' N ' HD22 ' A' ' 62' ' ' ASN . 1.0 OUTLIER -63.79 -21.68 66.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.548 -177.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -77.36 -58.62 3.17 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.91 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.623 ' CE1' ' HG3' ' A' ' 141' ' ' LYS . 96.2 m-85 -109.14 -10.65 14.98 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -165.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -53.65 -37.87 63.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.219 0.463 . . . . 0.0 111.849 -176.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.4 m -67.64 -15.21 63.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -107.99 9.61 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 0.0 111.054 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.439 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 104.88 48.97 1.04 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.912 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.674 ' HD1' HG23 ' A' ' 37' ' ' VAL . 72.4 t80 -121.92 138.77 54.28 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.681 ' HG2' HD11 ' A' ' 33' ' ' LEU . 8.7 tp10 -138.69 146.03 41.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.287 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.422 HD12 ' CE3' ' A' ' 92' ' ' TRP . 72.2 mt -112.41 124.64 69.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.927 0.394 . . . . 0.0 110.239 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.595 ' CE1' HG21 ' A' ' 95' ' ' VAL . 89.9 t80 -104.5 100.0 9.68 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.824 HE21 ' HA ' ' A' ' 73' ' ' GLN . 0.0 OUTLIER -83.49 136.67 34.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.861 -177.691 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -125.78 108.32 19.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.76 ' HA ' ' O ' ' A' ' 43' ' ' THR . 66.5 p -83.11 126.3 32.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.309 0.576 . . . . 0.0 111.189 -175.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.519 HD22 ' H ' ' A' ' 101' ' ' ALA . 17.3 mt -102.94 39.36 1.56 Allowed 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.594 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.8 p-10 -61.42 -71.91 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.266 -170.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.41 12.25 42.3 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -170.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -163.1 100.47 0.97 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.9 -26.37 61.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.008 -171.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -74.02 -29.1 61.76 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.694 -0.803 . . . . 0.0 110.89 -174.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -71.68 -48.9 44.38 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.579 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 27.9 t90 -60.67 -47.19 87.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.293 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.86 ' HA ' HD11 ' A' ' 23' ' ' LEU . 12.2 ttmt -62.35 -45.33 93.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.639 0.257 . . . . 0.0 111.497 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -68.12 -31.23 70.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.461 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.4 p -85.58 -33.67 21.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.897 0.38 . . . . 0.0 111.651 -177.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.522 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -86.32 -18.92 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.604 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 15.1 t70 -64.12 -27.05 68.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.899 0.381 . . . . 0.0 111.789 -173.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -97.0 8.23 44.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.282 0.563 . . . . 0.0 110.419 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.3 mt -86.89 152.21 53.32 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.179 0.514 . . . . 0.0 111.726 -177.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.594 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -72.53 -58.67 0.07 OUTLIER 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.691 2.928 . . . . 0.0 114.046 -176.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.594 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.9 p90 -83.35 -173.79 4.91 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.98 124.63 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 m -117.94 109.47 16.54 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.704 HG11 ' HB2' ' A' ' 20' ' ' LEU . 11.3 t -115.99 156.56 17.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.814 -176.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.427 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 14.8 ttp180 -113.21 139.62 48.63 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.487 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.67 156.99 20.44 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.955 0.407 . . . . 0.0 110.065 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.453 ' C ' HD22 ' A' ' 99' ' ' ASN . . . -82.04 -29.17 32.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -175.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.453 HD22 ' C ' ' A' ' 98' ' ' ALA . 0.9 OUTLIER -114.26 -14.1 12.3 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -171.811 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.405 ' O ' ' HB3' ' A' ' 101' ' ' ALA . . . 67.56 78.03 0.3 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.486 178.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.519 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 80.42 -31.53 0.12 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.878 0.871 . . . . 0.0 111.897 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -85.01 37.34 0.66 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.344 0.593 . . . . 0.0 110.016 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.547 ' HB3' HG13 ' A' ' 106' ' ' ILE . 22.8 t -89.7 141.95 28.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.126 -172.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.438 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 2.9 p -61.28 -38.22 85.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.178 178.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -55.35 -44.48 75.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.377 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.547 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.5 mt -64.27 -28.94 46.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.011 -176.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 27.9 m -77.8 -24.76 48.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.582 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.9 mt -71.18 -37.23 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.993 -179.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.558 ' OH ' HD11 ' A' ' 18' ' ' ILE . 93.3 m-85 -69.87 -23.14 63.22 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.292 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 . . . . . 0 C--N 1.327 -0.378 0 CA-C-O 122.384 1.088 . . . . 0.0 108.801 -167.327 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.642 HD13 ' OG ' ' A' ' 116' ' ' SER . 3.0 mm? . . . . . 0 N--CA 1.469 0.486 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.429 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 24.1 Cg_exo -65.26 152.52 77.46 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 124.474 -1.052 . . . . 0.0 112.655 0.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.642 ' OG ' HD13 ' A' ' 114' ' ' LEU . 13.0 m -127.55 166.12 18.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.036 -175.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 40' ' ' ILE . 7.9 p -143.28 154.56 16.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.557 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 84.4 m-85 -139.02 163.74 31.6 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 176.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.897 HD13 HD11 ' A' ' 136' ' ' LEU . 14.7 tp -110.53 135.43 51.2 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 44.9 t -133.62 125.08 49.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.754 0.312 . . . . 0.0 110.484 176.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.577 ' HB3' HD22 ' A' ' 143' ' ' LEU . 8.9 p30 -82.9 166.75 18.65 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -75.31 18.62 0.2 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -169.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.467 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 63.4 t30 -95.22 -0.86 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 166.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.815 HD21 ' HB3' ' A' ' 30' ' ' LEU . 2.4 t-20 59.78 67.21 0.9 Allowed 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.561 -165.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.1 mm-40 -137.83 141.76 40.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.326 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 47.8 mt -68.88 130.79 43.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.536 0.684 . . . . 0.0 110.729 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.84 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 73.2 m -101.63 -49.87 3.88 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.942 -177.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -164.86 164.5 20.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.859 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.418 ' O ' HG13 ' A' ' 133' ' ' ILE . 92.8 mtt180 -96.96 162.24 13.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.21 -36.37 92.3 Favored Glycine 0 C--O 1.226 -0.374 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.242 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -76.46 -1.87 29.28 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 0.0 110.736 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -112.49 -18.13 12.49 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 110.539 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.703 HD13 HD13 ' A' ' 136' ' ' LEU . 96.7 mt -88.82 110.13 20.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.3 0.572 . . . . 0.0 111.247 -175.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.656 ' HG3' ' H ' ' A' ' 135' ' ' ASP . 11.2 ptmm? -72.94 -60.07 2.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 174.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.656 ' H ' ' HG3' ' A' ' 134' ' ' LYS . 7.2 m-20 -128.06 116.67 20.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.897 HD11 HD13 ' A' ' 119' ' ' LEU . 2.9 tp -75.28 -27.25 59.31 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.293 0.568 . . . . 0.0 109.553 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -52.55 -56.29 16.28 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.608 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.416 ' HG2' ' HB2' ' A' ' 135' ' ' ASP . 12.1 pt-20 -62.46 -48.65 78.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.033 0.444 . . . . 0.0 111.33 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 138' ' ' GLU . . . -55.95 -54.25 46.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.286 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.81 HD12 HD12 ' A' ' 60' ' ' LEU . 27.0 mt -63.5 -29.68 47.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.727 0.299 . . . . 0.0 111.247 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.623 ' HG3' ' CE1' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -61.8 -43.81 98.11 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 110.018 177.508 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 59.5 mmtt -75.27 -19.2 59.84 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.014 -178.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.577 HD22 ' HB3' ' A' ' 121' ' ' ASN . 40.2 mt -71.82 -40.25 69.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.289 0.566 . . . . 0.0 110.506 175.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.495 HD11 ' HB3' ' A' ' 64' ' ' TYR . 95.4 mt . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.56 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.576 HG21 ' O ' ' A' ' 124' ' ' ASN . 13.5 tt . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 121.264 0.554 . . . . 0.0 111.762 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.453 HG12 HD13 ' A' ' 108' ' ' LEU . 4.4 mp -99.31 130.65 47.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.486 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -75.85 107.51 8.08 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.505 HD11 ' OH ' ' A' ' 109' ' ' TYR . 9.2 mt -89.02 105.37 15.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.686 -172.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.674 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 76.8 mt-30 -100.12 99.95 10.73 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.522 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.8 mt -136.82 153.11 50.89 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 176.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.68 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 90.8 mttt -87.87 136.23 33.05 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.907 0.86 . . . . 0.0 112.103 -173.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.08 165.85 3.99 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.5 -1.682 . . . . 0.0 108.952 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.531 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER -59.43 -30.05 68.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.642 0.734 . . . . 0.0 110.143 179.083 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.521 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 36.3 mtmm -69.05 -8.54 46.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.13 176.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.39 8.06 61.49 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.406 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -97.23 111.98 23.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.7 0.286 . . . . 0.0 111.538 -176.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.68 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 52.7 m -57.93 118.47 5.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.329 0.585 . . . . 0.0 111.225 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.674 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 24.3 mmt180 -93.51 143.87 25.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.648 176.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.1 p -122.79 150.82 42.3 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 170.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.659 ' HB3' HD21 ' A' ' 124' ' ' ASN . 31.4 mt -71.03 -29.9 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.051 0.453 . . . . 0.0 109.974 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 p -61.86 -19.42 62.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.425 175.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.25 -38.34 16.41 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.724 0.773 . . . . 0.0 109.848 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.643 HD23 HG13 ' A' ' 38' ' ' VAL . 11.5 tp -78.55 -1.51 34.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.884 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.561 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 36.1 ttpt -64.77 -10.59 28.83 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.476 0.655 . . . . 0.0 111.068 179.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.11 -15.27 60.45 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.917 -0.658 . . . . 0.0 111.734 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -132.2 -179.23 5.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.416 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.495 HG22 ' HB3' ' A' ' 122' ' ' ARG . 99.7 t -84.8 128.9 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 170.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.643 HG13 HD23 ' A' ' 33' ' ' LEU . 43.6 t -106.57 122.77 60.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.292 0.568 . . . . 0.0 112.396 -162.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.671 HD11 HD21 ' A' ' 136' ' ' LEU . 13.3 tp -95.08 116.94 29.36 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.93 172.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.627 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 20.7 mm -91.4 106.34 17.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 178.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.551 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.0 t70 -107.53 141.38 39.06 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.73 0.3 . . . . 0.0 111.101 -178.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -128.46 111.84 13.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.699 174.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 t -154.84 175.09 14.18 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.937 0.399 . . . . 0.0 111.006 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.661 HG23 ' HB2' ' A' ' 47' ' ' ASN . 7.9 m -112.98 121.68 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.923 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -75.99 83.83 2.88 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 173.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 179.98 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.684 -167.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.661 ' HB2' HG23 ' A' ' 44' ' ' VAL . 2.1 t-20 -88.5 149.61 23.54 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.387 -168.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.01 -29.97 69.1 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.67 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.7 -25.55 64.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.555 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 m -67.85 -27.49 66.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.14 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.22 -54.59 38.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.63 -38.03 86.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.171 0.51 . . . . 0.0 110.568 178.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.43 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.4 t60 -61.6 -40.91 96.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.711 179.018 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.587 ' HA ' HD12 ' A' ' 57' ' ' LEU . 18.2 t-20 -71.33 -34.72 70.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.749 -178.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.58 -41.76 92.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.29 80.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.328 0.585 . . . . 0.0 110.205 176.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 ' HA ' ' A' ' 54' ' ' ASN . 58.8 mt -67.34 -39.67 85.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.663 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.47 ' HD2' ' OD1' ' A' ' 62' ' ' ASN . 3.3 tpp180 -61.31 -24.96 66.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.289 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -74.46 -56.11 5.22 Favored 'General case' 0 CA--C 1.488 -1.436 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.604 HD11 ' HA ' ' A' ' 137' ' ' ASP . 2.1 mm? -56.19 -29.14 60.49 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-N 111.749 -2.478 . . . . 0.0 111.11 177.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.409 ' CE2' ' HB2' ' A' ' 91' ' ' PRO . 37.6 t80 -76.38 -52.95 8.87 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.439 -178.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.47 ' OD1' ' HD2' ' A' ' 58' ' ' ARG . 5.9 m-20 -62.48 -22.38 66.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.171 0.51 . . . . 0.0 110.369 -178.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -81.19 -62.05 1.77 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.832 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.614 ' HB3' ' CD1' ' A' ' 144' ' ' LEU . 87.9 m-85 -107.76 -8.08 16.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -163.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.524 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.48 -16.89 64.46 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.706 -0.621 . . . . 0.0 111.428 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.8 m -85.56 5.6 30.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.525 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -118.41 14.83 13.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.214 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.17 43.01 3.88 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.832 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.524 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 83.3 t80 -127.91 138.81 52.79 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -177.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -145.24 141.59 28.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 0.0 109.847 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.476 HD12 ' CE3' ' A' ' 92' ' ' TRP . 56.3 mt -99.06 132.79 43.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.941 -174.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.515 ' HB2' ' CD2' ' A' ' 33' ' ' LEU . 90.1 t80 -111.02 101.43 9.99 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.067 177.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 6.1 tt0 -102.72 119.11 38.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.15 0.5 . . . . 0.0 111.399 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.466 HD11 HG21 ' A' ' 18' ' ' ILE . 69.9 mt -96.69 127.93 48.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.777 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.0 m -100.37 129.63 46.37 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.401 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.513 HD13 HD12 ' A' ' 114' ' ' LEU . 0.7 OUTLIER -123.86 22.28 8.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.075 0.464 . . . . 0.0 110.461 177.569 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.536 ' HB3' ' HB ' ' A' ' 44' ' ' VAL . 4.6 p-10 -79.09 178.68 7.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.085 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.09 30.84 5.7 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.608 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -135.64 102.49 5.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.639 . . . . 0.0 111.028 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 28.5 tt0 -69.81 -18.33 63.46 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.876 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -70.09 -59.5 2.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.931 -176.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -66.32 -36.06 81.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.502 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.531 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 33.2 t90 -57.56 -60.05 4.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.866 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.451 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 31.6 ttmt -61.17 -44.19 97.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.144 -174.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.3 m -62.41 -49.13 76.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.439 -178.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.636 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.1 t -70.82 -45.94 63.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.618 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.457 ' HB1' HD22 ' A' ' 23' ' ' LEU . . . -58.85 -40.58 84.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -175.298 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.33 -28.84 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.294 0.569 . . . . 0.0 110.611 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -96.99 7.26 47.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.306 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 86' ' ' SER . 32.3 mt -100.01 153.59 37.68 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-O 121.177 0.513 . . . . 0.0 111.837 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.637 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.6 Cg_endo -75.17 -45.32 0.28 Allowed 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 123.958 3.106 . . . . 0.0 114.005 -176.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.637 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.0 p90 -94.96 -171.04 2.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.443 . . . . 0.0 112.021 -171.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.2 t -80.05 124.83 38.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.668 -174.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 39.1 m -123.44 109.4 13.8 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.379 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 18.6 m -122.31 161.51 23.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.885 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.423 HH12 ' HB2' ' A' ' 80' ' ' GLU . 59.4 ttp180 -124.47 144.21 50.21 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.054 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.97 163.44 24.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.125 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.0 -32.82 30.39 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -177.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.564 ' HB3' ' HB2' ' A' ' 102' ' ' TYR . 64.9 m-20 -113.75 -12.41 12.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.691 0.281 . . . . 0.0 111.488 -172.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.83 -116.3 5.58 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.207 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.29 -14.34 62.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.064 0.459 . . . . 0.0 111.118 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.564 ' HB2' ' HB3' ' A' ' 99' ' ' ASN . 97.8 m-85 -96.5 19.64 11.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.369 177.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.459 ' HB3' HG13 ' A' ' 106' ' ' ILE . 45.4 t -66.79 138.99 57.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.016 -178.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.583 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.9 m -67.61 -25.84 65.95 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.281 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.52 ' HA ' HD12 ' A' ' 108' ' ' LEU . 98.0 m-85 -61.7 -42.3 98.76 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.203 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.459 HG13 ' HB3' ' A' ' 103' ' ' SER . 67.5 mt -59.94 -32.72 50.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.841 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.2 m -76.81 -33.3 57.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.852 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -62.92 -39.5 94.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.735 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.505 ' OH ' HD11 ' A' ' 18' ' ' ILE . 68.3 m-85 -81.57 -19.42 42.04 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.438 178.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 t30 . . . . . 0 CA--C 1.512 -0.504 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -166.082 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.705 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 80.0 mt . . . . . 0 CA--C 1.534 0.34 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.705 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.96 153.94 96.23 Favored 'Cis proline' 0 C--N 1.355 0.891 0 CA-C-N 120.005 1.037 . . . . 0.0 113.202 0.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 69.1 m -145.13 172.91 12.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.481 -177.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.574 HG12 ' HA3' ' A' ' 130' ' ' GLY . 2.7 p -142.31 158.75 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.627 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 95.3 m-85 -140.96 161.95 36.63 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 176.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.804 HD13 HD11 ' A' ' 136' ' ' LEU . 17.0 tp -111.05 134.56 52.55 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.175 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.579 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 16.8 t -131.1 119.07 43.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.886 0.374 . . . . 0.0 110.182 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.598 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 3.5 p30 -74.69 164.44 26.58 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.495 ' HB3' HG22 ' A' ' 37' ' ' VAL . 18.0 ptt180 -52.56 -19.19 2.12 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 124.429 1.081 . . . . 0.0 113.795 -171.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -84.3 11.49 8.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.068 0.461 . . . . 0.0 109.907 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.659 HD21 ' HB3' ' A' ' 30' ' ' LEU . 1.8 t-20 57.79 55.35 5.5 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.161 -176.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.598 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 31.7 mt-10 -129.06 146.74 50.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.554 178.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.3 mt -72.61 112.09 8.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.171 0.51 . . . . 0.0 111.029 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.641 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 9.9 m -74.3 -56.87 4.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.527 177.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.94 170.93 11.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.909 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.567 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 14.7 mmt180 -82.89 152.67 25.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.574 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -62.28 -34.04 87.97 Favored Glycine 0 CA--C 1.509 -0.337 0 N-CA-C 111.712 -0.555 . . . . 0.0 111.712 177.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 131' ' ' GLU . 17.8 mp0 -64.35 -28.68 69.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.682 -0.759 . . . . 0.0 110.21 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -99.47 -6.32 27.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.752 -171.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 129' ' ' ARG . 85.0 mt -102.76 108.52 24.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.182 -179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.409 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 18.5 pttp -64.17 -48.56 75.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.942 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.409 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 7.3 m-20 -127.77 107.38 9.84 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.804 HD11 HD13 ' A' ' 119' ' ' LEU . 7.3 tp -74.92 -34.6 62.14 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -178.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.604 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.5 t70 -46.93 -58.2 4.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.682 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -62.72 -45.37 93.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.562 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.515 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.7 -52.24 64.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.695 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.661 HG13 ' O ' ' A' ' 136' ' ' LEU . 52.5 mt -57.82 -45.83 87.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 0.0 110.395 177.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 66.7 tttm -52.69 -46.52 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.934 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 34.3 mttm -71.5 -29.37 64.73 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 81.4 mt -65.22 -41.72 94.13 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.787 0.803 . . . . 0.0 109.484 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.614 ' CD1' ' HB3' ' A' ' 64' ' ' TYR . 70.8 mt . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.879 -178.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.565 HD12 ' O ' ' A' ' 124' ' ' ASN . 2.4 tt . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.971 0.415 . . . . 0.0 110.869 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.7 mp -107.05 114.08 45.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 171.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.47 108.46 14.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.119 0.485 . . . . 0.0 109.953 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 29' ' ' SER . 7.0 mt -94.93 124.9 47.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.612 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -120.97 99.21 6.37 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.546 -177.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.468 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 43.3 mt -131.09 159.1 38.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.9 mttp -90.19 142.57 27.58 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.04 0.448 . . . . 0.0 111.904 -178.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.58 ' OD1' ' HG2' ' A' ' 24' ' ' LYS . 15.9 t70 -75.88 176.89 7.41 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.092 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.92 HD11 ' HB3' ' A' ' 87' ' ' ALA . 3.0 mm? -46.81 -39.77 12.49 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 123.608 0.763 . . . . 0.0 110.889 177.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.58 ' HG2' ' OD1' ' A' ' 22' ' ' ASP . 30.6 mmtm -60.08 -48.92 79.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.954 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 9.62 3.97 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.831 -0.907 . . . . 0.0 110.831 -176.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.438 ' OD1' ' HB3' ' A' ' 22' ' ' ASP . 2.2 p30 -103.5 130.72 50.93 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.8 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.602 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 42.2 m -70.08 128.95 38.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.206 0.527 . . . . 0.0 111.313 -178.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.546 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 15.3 mmm180 -112.18 132.99 54.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.984 175.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.7 p -121.53 163.49 18.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.785 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.474 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 73.6 mt -76.11 -28.78 57.63 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 177.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 p -67.14 -14.58 63.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.371 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.02 -32.01 19.02 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.533 ' HB3' HG21 ' A' ' 38' ' ' VAL . 4.0 mp -90.71 10.04 27.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.905 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.665 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.4 ttmm -72.86 128.25 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.137 0.494 . . . . 0.0 110.372 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.07 -20.38 9.17 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 -172.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -109.22 168.71 9.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.922 -0.639 . . . . 0.0 110.376 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.833 HG23 ' HD2' ' A' ' 122' ' ' ARG . 80.6 t -91.34 118.58 36.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 169.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.732 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 95.2 t -111.5 131.38 62.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 121.716 0.769 . . . . 0.0 112.129 -169.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.9 tt -92.27 110.0 21.39 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.159 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.648 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 3.0 mp -84.19 106.49 14.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 175.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.624 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 26.1 t0 -98.55 144.74 27.54 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.601 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.539 ' HB3' HD21 ' A' ' 114' ' ' LEU . 21.7 m-85 -133.41 105.85 7.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 175.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.9 t -154.18 155.82 35.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.148 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.511 HG13 HD23 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -96.79 118.89 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.139 172.721 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.402 ' HD1' ' OG ' ' A' ' 75' ' ' SER . 17.7 m-85 -66.71 87.77 0.13 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 170.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 177.82 -35.51 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.102 -1.408 . . . . 0.0 109.157 -168.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -89.01 142.3 27.76 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.207 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.42 -29.81 64.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.961 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.4 mmm -64.32 -20.13 65.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.602 0.239 . . . . 0.0 111.337 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.4 t -64.99 -27.16 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.31 -50.17 61.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.388 . . . . 0.0 110.598 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.36 -29.41 69.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.418 0.627 . . . . 0.0 110.314 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.564 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 62.5 t60 -68.08 -47.38 68.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.5 176.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.577 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.2 m-20 -65.37 -27.14 68.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.985 178.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.76 -53.68 54.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.407 0.622 . . . . 0.0 109.886 174.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.95 74.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.662 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 54' ' ' ASN . 93.2 mt -63.92 -39.57 94.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.882 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -64.23 -26.04 68.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.728 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 5.1 tt0 -78.02 -50.46 12.06 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -177.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 63' ' ' LYS . 19.0 mt -53.72 -34.47 58.97 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 112.448 -2.16 . . . . 0.0 111.179 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.462 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 35.5 t80 -67.67 -45.76 74.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.275 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -68.04 -21.28 65.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.998 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.561 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 60.7 mttm -85.49 -61.15 1.83 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.679 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.583 ' HB3' HD11 ' A' ' 144' ' ' LEU . 66.8 m-85 -106.27 -14.8 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -163.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.548 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.35 169.7 11.78 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.92 -177.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 24.7 m 72.82 -35.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.386 0.675 . . . . 0.0 111.46 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 65' ' ' ALA . 47.6 mt-30 -81.87 11.03 5.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 110.944 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.4 47.53 1.3 Allowed Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.669 -176.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.548 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 64.5 t80 -141.43 134.65 29.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -143.55 150.05 38.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.499 HD12 ' CE3' ' A' ' 92' ' ' TRP . 58.5 mt -110.36 127.38 67.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.075 0.464 . . . . 0.0 110.299 -177.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.487 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.8 t80 -119.56 100.59 7.37 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.495 -176.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.624 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 44.1 mt-30 -93.29 117.01 29.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.234 -175.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.47 HD11 ' CE2' ' A' ' 72' ' ' TYR . 16.7 mm -86.58 113.96 25.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.651 171.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.402 ' OG ' ' HD1' ' A' ' 45' ' ' TYR . 42.2 t -105.11 111.6 24.42 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.334 0.588 . . . . 0.0 110.781 179.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.521 HD13 ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -102.74 39.3 1.55 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.548 177.047 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.482 ' HA ' HG12 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -50.31 -73.77 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.289 -1.323 . . . . 0.0 113.621 -173.697 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 124.94 -7.07 8.24 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 111.107 -0.797 . . . . 0.0 111.107 -172.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -142.34 119.12 11.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 20.9 tt0 -68.08 -41.74 81.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.955 -173.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 -79.9 -24.33 41.2 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -168.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -70.95 -48.83 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.569 ' CZ2' HD13 ' A' ' 23' ' ' LEU . 12.5 t90 -61.83 -47.07 86.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.891 176.238 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.915 ' HA ' HD12 ' A' ' 23' ' ' LEU . 60.3 tttt -62.13 -44.27 97.01 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.4 p -69.75 -41.09 75.67 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.91 0.386 . . . . 0.0 111.397 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.7 p -76.7 -42.79 40.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.857 -176.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.92 ' HB3' HD11 ' A' ' 23' ' ' LEU . . . -79.57 -24.63 41.96 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -171.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.4 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 24.6 t70 -71.8 -8.78 56.34 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.506 0.67 . . . . 0.0 110.442 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -101.8 9.94 40.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.119 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.862 ' HG ' ' O ' ' A' ' 87' ' ' ALA . 3.7 pp -98.44 158.2 33.03 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.968 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.764 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 32.5 Cg_endo -85.03 -3.06 9.66 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 124.062 3.174 . . . . 0.0 114.693 -172.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.835 ' CD1' HD13 ' A' ' 90' ' ' LEU . 2.4 p90 -122.55 -153.64 0.56 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.546 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 83.9 t -103.28 134.3 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -177.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.463 ' HB3' HD21 ' A' ' 23' ' ' LEU . 39.1 t -137.93 112.86 9.06 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.45 0.643 . . . . 0.0 109.539 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.468 ' CG2' ' HB2' ' A' ' 20' ' ' LEU . 27.4 m -114.6 148.07 17.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.896 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.478 ' HD2' ' CE3' ' A' ' 83' ' ' TRP . 36.1 ttt180 -100.24 137.49 38.61 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.92 0.391 . . . . 0.0 111.215 -174.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -87.09 146.01 26.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.265 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.64 -28.36 30.77 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 4.8 m-20 -91.53 -13.83 31.42 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -171.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 54.84 72.75 0.5 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.451 -0.404 . . . . 0.0 113.357 176.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.502 ' N ' ' HB2' ' A' ' 76' ' ' LEU . . . 78.2 -15.81 0.72 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.721 0.808 . . . . 0.0 111.858 177.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.54 25.24 5.89 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.443 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.9 OUTLIER -66.47 135.13 53.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.116 -176.393 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.616 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 26.2 m -55.65 -36.3 66.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.517 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.55 -46.12 84.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.191 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.443 HG13 ' HB2' ' A' ' 103' ' ' SER . 65.8 mt -57.54 -43.48 83.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.753 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -67.59 -32.25 72.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.103 176.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 104' ' ' SER . 84.9 mt -65.7 -39.71 91.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.278 -179.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.423 ' O ' ' CB ' ' A' ' 110' ' ' ASN . 65.2 m-85 -77.12 -50.96 11.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.558 175.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.423 ' CB ' ' O ' ' A' ' 109' ' ' TYR . 8.6 t30 . . . . . 0 N--CA 1.478 0.941 0 O-C-N 125.525 1.766 . . . . 0.0 108.226 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.539 HD21 ' HB3' ' A' ' 42' ' ' PHE . 2.4 mp . . . . . 0 C--O 1.236 0.39 0 CA-C-O 120.556 0.217 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.401 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 4.9 Cg_exo -73.78 159.03 98.16 Favored 'Cis proline' 0 C--N 1.35 0.646 0 C-N-CA 123.249 -1.563 . . . . 0.0 112.053 0.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.8 m -145.81 175.76 10.17 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.567 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.9 p -143.11 155.12 17.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.648 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 93.3 m-85 -133.8 155.63 49.46 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.983 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 5.1 tp -118.41 143.93 46.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.318 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.735 HG12 ' HA ' ' A' ' 126' ' ' LEU . 14.5 m -138.99 140.15 39.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.078 0.466 . . . . 0.0 110.115 167.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.576 ' HB3' HD22 ' A' ' 143' ' ' LEU . 1.1 p-10 -89.49 178.29 6.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.859 -176.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.833 ' HD2' HG23 ' A' ' 37' ' ' VAL . 9.8 mmm180 -38.14 -48.2 1.22 Allowed 'General case' 0 N--CA 1.481 1.115 0 O-C-N 124.808 1.318 . . . . 0.0 113.813 -171.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.49 9.5 1.04 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.453 -176.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.665 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 1.6 t-20 54.28 57.95 5.4 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 123.594 0.758 . . . . 0.0 110.305 -171.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -128.09 140.15 52.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.716 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.735 ' HA ' HG12 ' A' ' 120' ' ' VAL . 3.8 tt -62.12 121.02 12.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.681 0.753 . . . . 0.0 111.295 -170.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.983 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 68.8 m -84.92 -54.58 4.57 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.436 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.497 ' HB1' ' OD1' ' A' ' 132' ' ' ASN . . . -168.98 173.6 6.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 -174.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.473 ' O ' HG13 ' A' ' 133' ' ' ILE . 89.7 mtt180 -110.58 158.83 18.14 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.805 -178.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.83 -14.99 32.71 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.06 173.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.25 -28.03 62.88 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 122.469 0.308 . . . . 0.0 111.033 176.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.497 ' OD1' ' HB1' ' A' ' 128' ' ' ALA . 24.6 p30 -127.57 -7.12 5.72 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.725 HG21 ' HG ' ' A' ' 136' ' ' LEU . 89.8 mt -78.8 108.63 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.564 ' HD2' ' H ' ' A' ' 134' ' ' LYS . 0.1 OUTLIER -58.42 -51.11 71.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.797 0.808 . . . . 0.0 110.009 178.122 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.557 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 9.8 t70 -154.38 124.91 6.99 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.137 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.725 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.7 mp -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.74 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -48.55 -52.69 21.46 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 123.051 0.219 . . . . 0.0 111.409 174.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -69.66 -38.79 77.22 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.321 0.581 . . . . 0.0 111.542 -179.156 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.649 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -62.81 -53.2 57.97 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.854 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.549 HG13 ' O ' ' A' ' 136' ' ' LEU . 41.7 mt -62.0 -32.03 53.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.271 0.558 . . . . 0.0 110.397 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -58.8 -43.08 90.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.412 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? -84.65 -18.84 34.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.203 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 30.8 mt -73.18 -41.84 63.4 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.25 178.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.583 HD11 ' HB3' ' A' ' 64' ' ' TYR . 21.1 mt . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 121.434 0.635 . . . . 0.0 109.72 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.805 HG13 ' HG ' ' A' ' 126' ' ' LEU . 12.1 tt . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.488 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.6 mp -101.5 109.03 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 172.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.437 ' HA ' HD12 ' A' ' 30' ' ' LEU . 25.8 t0 -73.51 131.97 42.36 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.434 HG23 ' CZ ' ' A' ' 105' ' ' TYR . 7.3 mt -113.29 111.58 36.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.138 -175.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.552 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.2 mp0 -98.87 100.16 11.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.296 178.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.95 154.39 51.12 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 89.7 mttt -85.34 143.19 28.81 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.925 0.393 . . . . 0.0 110.854 -175.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.4 p-10 -76.68 -167.13 0.76 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.929 -178.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.651 HD11 ' HG3' ' A' ' 84' ' ' LYS . 36.9 tp -56.67 -36.32 69.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.406 ' HB2' HD22 ' A' ' 26' ' ' ASN . 66.0 mttm -79.66 -33.52 41.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.675 -178.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.457 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 116.49 20.24 5.13 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.065 -177.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.406 HD22 ' HB2' ' A' ' 24' ' ' LYS . 36.3 m-80 -95.92 114.87 26.63 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 175.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.7 m -61.99 115.49 4.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.357 0.599 . . . . 0.0 111.182 178.024 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.552 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 18.8 mmm180 -92.27 142.1 27.84 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.501 175.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.5 p -120.1 159.5 24.7 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 172.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.607 ' HB3' HD21 ' A' ' 124' ' ' ASN . 71.7 mt -80.91 -28.79 35.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.689 0.281 . . . . 0.0 111.229 -177.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.87 0.64 8.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.97 0.414 . . . . 0.0 111.241 175.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -83.45 -50.34 8.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.667 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.567 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -98.73 26.02 6.02 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.854 0.835 . . . . 0.0 110.277 -176.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.622 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 30.3 ttpt -59.47 -26.57 65.35 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 113.976 -1.465 . . . . 0.0 112.514 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -56.5 -21.72 35.8 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 116.279 -0.419 . . . . 0.0 113.866 -176.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.615 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -138.41 -169.66 2.64 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 116.859 0.329 . . . . 0.0 110.522 178.483 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.668 HG11 ' HB3' ' A' ' 143' ' ' LEU . 27.6 m -82.52 143.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 -176.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.551 HG22 ' HG ' ' A' ' 33' ' ' LEU . 21.5 t -119.98 137.89 52.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.975 -173.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.667 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.7 tp -102.66 106.2 16.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.969 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.636 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.2 mm -84.74 106.47 14.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.558 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 5.1 t70 -108.42 135.08 50.31 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.705 0.288 . . . . 0.0 111.032 -175.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.539 ' HB3' HD11 ' A' ' 76' ' ' LEU . 59.8 m-85 -123.13 99.92 6.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.565 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 15.8 m -138.81 149.66 45.19 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.018 0.437 . . . . 0.0 111.847 -170.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 47' ' ' ASN . 13.7 m -96.13 115.71 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 121.178 0.513 . . . . 0.0 110.755 176.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.536 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 36.7 m-85 -78.73 85.4 4.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.576 0.703 . . . . 0.0 109.477 176.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 178.25 -34.69 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.352 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.547 ' HB2' HG23 ' A' ' 44' ' ' VAL . 2.7 t-20 -84.04 163.45 19.89 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.698 -171.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.83 -30.4 40.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.339 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.6 tpt -62.5 -26.53 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.738 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 m -60.79 -34.13 74.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.141 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.64 -52.22 65.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.633 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.83 81.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.856 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.49 ' HE2' ' CG ' ' A' ' 41' ' ' ASP . 73.5 t60 -61.97 -51.57 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.81 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.572 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.0 m-20 -75.01 -18.01 60.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.589 -177.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 1.8 tm? -69.03 -51.34 40.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.02 -39.17 84.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.502 178.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.572 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.2 mt -60.65 -38.95 86.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.086 174.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 7.5 tpp180 -62.83 -27.83 69.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.563 179.128 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -78.13 -51.01 10.9 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.714 HD12 HD12 ' A' ' 140' ' ' ILE . 2.9 mm? -56.09 -32.27 63.99 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 112.735 -2.03 . . . . 0.0 111.07 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.503 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 30.5 t80 -70.21 -49.12 53.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.084 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -64.03 -21.41 66.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.654 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -84.05 -61.74 1.74 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.063 -177.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.515 ' HB3' HD11 ' A' ' 144' ' ' LEU . 84.9 m-85 -113.84 -18.2 11.86 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -166.023 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.47 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.57 161.5 29.45 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.004 -176.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.5 m 77.73 -34.76 0.2 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.529 0.732 . . . . 0.0 111.543 -177.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' A' ' 67' ' ' GLN . 1.6 mp0 -85.24 11.04 10.79 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.068 177.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.612 ' O ' ' HB2' ' A' ' 36' ' ' LYS . . . 121.47 27.53 1.78 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.35 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.667 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 56.2 t80 -134.98 130.06 35.17 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 176.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.615 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 3.0 tt0 -133.3 156.26 47.92 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.261 178.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.477 HD12 ' CE3' ' A' ' 92' ' ' TRP . 54.2 mt -120.78 131.6 72.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.391 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.498 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 66.2 t80 -121.17 101.02 7.39 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.09 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.558 ' HG3' ' HB3' ' A' ' 41' ' ' ASP . 7.3 tt0 -105.91 145.76 30.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.014 0.435 . . . . 0.0 111.052 -176.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.423 HD11 ' HE2' ' A' ' 72' ' ' TYR . 46.5 mt -126.51 127.58 70.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.959 -177.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.536 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 2.6 p -85.34 121.81 28.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.962 0.41 . . . . 0.0 110.955 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.58 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 12.1 mt -110.39 9.07 23.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.387 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.497 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.0 OUTLIER -68.66 -68.71 0.38 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.05 -175.808 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.64 23.24 6.02 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -174.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -134.57 98.85 4.18 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.523 ' HG2' ' CE3' ' A' ' 83' ' ' TRP . 25.8 mt-10 -75.35 -14.47 60.48 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.677 -176.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -50.87 66.78 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.002 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -81.78 -30.48 32.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.225 -177.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.545 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 42.6 t90 -66.16 -52.0 52.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.097 175.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.651 ' HG3' HD11 ' A' ' 23' ' ' LEU . 19.1 ttmm -64.17 -43.47 95.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.934 -173.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.9 p -65.05 -43.24 92.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.666 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.428 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 38.1 t -74.46 -37.13 63.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.532 -178.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.566 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -69.91 -29.07 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -174.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.44 -23.02 66.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.305 0.574 . . . . 0.0 110.764 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -92.38 -8.18 45.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.83 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 86' ' ' SER . 34.8 mt -76.75 146.4 76.28 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.688 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 20.0 Cg_endo -91.25 -17.06 1.24 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 124.423 3.415 . . . . 0.0 113.523 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.688 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.4 p90 -115.93 -170.32 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.7 0.286 . . . . 0.0 110.94 -175.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.457 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 60.3 t -81.24 122.27 36.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.072 -176.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 49.8 t -125.8 109.31 12.39 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.957 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.489 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 17.2 m -117.63 158.75 18.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.892 -178.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.463 ' HA ' ' OG ' ' A' ' 75' ' ' SER . 19.0 ttp180 -107.91 136.23 47.97 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.139 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -80.77 155.54 26.63 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.55 -20.46 36.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.763 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.513 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 3.3 m-80 -122.19 -12.94 8.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.579 -173.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.58 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 70.97 -129.89 18.9 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.619 -0.8 . . . . 0.0 111.887 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.26 -5.63 29.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.851 0.357 . . . . 0.0 111.379 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -102.53 12.72 36.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.241 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.533 ' HB3' HG13 ' A' ' 106' ' ' ILE . 34.7 t -62.97 134.66 56.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.055 -177.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.505 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 8.0 m -61.26 -26.99 68.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.741 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.434 ' CZ ' HG23 ' A' ' 18' ' ' ILE . 64.1 m-85 -60.5 -45.09 95.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.611 178.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.533 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.6 mt -61.15 -36.0 69.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.508 -177.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.6 m -68.16 -35.64 78.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.724 178.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.5 mt -65.06 -35.25 80.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.439 -178.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.422 ' OH ' HD11 ' A' ' 18' ' ' ILE . 93.4 m-85 -74.24 -20.43 60.17 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.145 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.465 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.194 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -167.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.659 HD23 ' HB2' ' A' ' 116' ' ' SER . 64.9 mt . . . . . 0 C--O 1.234 0.246 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.565 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 20.4 Cg_exo -67.4 147.24 77.81 Favored 'Cis proline' 0 C--N 1.352 0.723 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.143 0.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.659 ' HB2' HD23 ' A' ' 114' ' ' LEU . 8.8 m -142.22 177.94 7.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.765 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.424 HG11 HD21 ' A' ' 136' ' ' LEU . 4.5 p -135.44 162.13 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.844 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.636 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 63.9 m-85 -138.78 160.22 40.21 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 175.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.846 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -110.44 139.0 46.08 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.473 -174.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.601 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 52.9 t -127.75 118.83 50.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.947 176.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.433 ' OD1' ' HB2' ' A' ' 125' ' ' GLU . 4.1 p-10 -76.75 162.63 27.52 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.987 176.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -69.78 27.82 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -167.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 121' ' ' ASN . 16.8 m120 -123.84 14.44 9.29 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 174.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.622 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 2.6 t-20 53.24 61.66 3.04 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.168 -169.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 68.6 mt-10 -130.88 150.74 51.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.175 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.805 ' HG ' HG13 ' A' ' 15' ' ' ILE . 24.7 mt -72.37 119.67 16.91 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.125 0.488 . . . . 0.0 110.103 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.846 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 35.5 m -83.42 -51.26 7.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.344 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -170.02 172.78 6.31 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.02 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.498 ' O ' HG13 ' A' ' 133' ' ' ILE . 82.0 mtm180 -103.16 158.39 16.34 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.404 -176.108 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.4 -35.82 73.78 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 121.565 -0.35 . . . . 0.0 112.892 -175.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.489 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.5 pm0 -77.61 -7.08 55.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.117 178.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -105.0 -20.18 13.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.732 HG21 ' HG ' ' A' ' 136' ' ' LEU . 60.5 mt -97.49 138.86 21.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.375 -176.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.59 1.07 4.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.088 0.471 . . . . 0.0 110.032 177.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -144.87 48.93 1.3 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.51 -168.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.732 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.9 mp -56.43 -38.91 72.24 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -176.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.41 -53.33 57.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.39 . . . . 0.0 110.031 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.517 ' HA ' ' HE2' ' A' ' 141' ' ' LYS . 66.0 mm-40 -62.72 -39.56 94.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.942 175.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 1.042 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.59 -56.9 16.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.648 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.714 HD12 HD12 ' A' ' 60' ' ' LEU . 52.0 mt -56.33 -42.37 73.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.378 0.609 . . . . 0.0 110.492 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.5 ttpt -60.41 -42.43 95.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.447 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 1.042 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 36.5 pttt -80.24 -23.45 40.85 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 120.659 0.266 . . . . 0.0 111.036 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.668 ' HB3' HG11 ' A' ' 37' ' ' VAL . 82.5 mt -70.72 -40.54 72.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.715 176.321 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 90.9 mt . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.921 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.4 tp . . . . . 0 N--CA 1.446 -0.671 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.496 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -101.16 105.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 176.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -76.11 111.07 11.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.257 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.4 HG22 ' HG ' ' A' ' 20' ' ' LEU . 13.2 mt -108.4 130.44 61.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.945 -177.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.541 ' HG3' ' HB3' ' A' ' 29' ' ' SER . 12.8 mp0 -111.56 100.7 9.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.514 -178.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.4 ' HG ' HG22 ' A' ' 18' ' ' ILE . 50.4 mt -130.06 154.64 47.23 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.509 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 92.8 mttt -88.79 146.57 24.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.804 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.747 ' OD2' ' HG2' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -85.45 -172.47 4.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 179.777 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.54 HD11 ' HG3' ' A' ' 84' ' ' LYS . 55.3 tp -51.43 -36.51 44.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.931 177.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.747 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 25.9 mmtm -72.79 -43.13 63.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.473 0.654 . . . . 0.0 110.012 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 125.62 11.16 4.17 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.665 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.539 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 39.6 m-80 -83.43 113.33 20.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 178.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.509 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 16.1 m -64.55 107.35 1.37 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.118 0.485 . . . . 0.0 110.02 173.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.519 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 17.6 mmm180 -93.02 138.57 31.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.163 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.541 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 2.9 p -118.29 154.18 32.72 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 16' ' ' ILE . 82.3 mt -77.37 -30.98 54.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.853 0.358 . . . . 0.0 110.738 -176.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.5 t -74.89 0.24 16.27 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.141 0.496 . . . . 0.0 110.67 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -87.97 -51.23 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.446 ' O ' ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -85.17 12.38 8.02 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 122.057 0.932 . . . . 0.0 110.644 -176.455 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.45 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 25.9 ttpp -56.27 124.08 16.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.728 169.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.71 -40.12 1.17 Allowed Glycine 0 CA--C 1.495 -1.217 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -172.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HB2' ' C ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -119.27 173.67 6.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 172.592 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.641 HG23 ' HD1' ' A' ' 69' ' ' PHE . 17.1 m -75.87 136.37 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.947 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.416 HG22 ' HG ' ' A' ' 33' ' ' LEU . 33.0 t -116.76 123.69 71.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.94 -171.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.626 ' HB3' HG23 ' A' ' 71' ' ' ILE . 10.5 tp -87.17 112.7 22.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.751 175.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.612 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.3 mm -87.36 105.08 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 18.1 t70 -109.65 134.88 51.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.761 0.315 . . . . 0.0 111.033 -175.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.549 ' HB3' HD13 ' A' ' 114' ' ' LEU . 61.7 m-85 -122.35 99.1 6.24 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.899 ' O ' ' HA ' ' A' ' 75' ' ' SER . 20.6 m -139.71 143.68 37.17 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.107 0.48 . . . . 0.0 111.5 -169.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.695 HG13 ' HB2' ' A' ' 47' ' ' ASN . 3.4 p -96.81 120.96 46.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 O-C-N 121.978 -0.451 . . . . 0.0 110.138 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.599 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 48.3 m-85 -77.22 79.38 3.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.749 0.785 . . . . 0.0 109.46 176.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -178.75 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.884 -1.507 . . . . 0.0 109.112 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.695 ' HB2' HG13 ' A' ' 44' ' ' VAL . 38.5 t-20 -65.41 140.43 58.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.627 -179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.89 -35.43 80.63 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.484 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -67.85 -19.89 65.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.065 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 m -68.03 -29.09 67.99 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.138 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.6 -55.58 16.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.832 0.349 . . . . 0.0 110.851 -178.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.07 86.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 0.0 110.711 178.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.623 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 72.1 t60 -61.58 -38.99 89.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.952 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.49 ' HA ' HD12 ' A' ' 57' ' ' LEU . 21.7 t-20 -68.73 -30.33 68.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.544 0.211 . . . . 0.0 110.712 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tt -69.74 -41.84 74.73 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.27 80.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.388 176.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 76.6 mt -67.98 -39.44 83.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.481 176.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 58' ' ' ARG . 2.0 tpp180 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.13 -52.96 12.28 Favored 'General case' 0 CA--C 1.493 -1.237 0 CA-C-O 122.743 1.258 . . . . 0.0 108.08 -173.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.86 HD12 HD12 ' A' ' 140' ' ' ILE . 2.3 mm? -55.76 -31.7 62.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 112.219 -2.264 . . . . 0.0 110.888 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -75.25 -50.12 17.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.894 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -61.15 -22.03 64.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.529 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -81.67 -60.74 2.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.077 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -104.66 -7.69 19.43 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -166.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.544 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.88 165.8 16.88 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.491 -0.483 . . . . 0.0 111.169 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 56.9 m 70.89 -10.95 0.69 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.779 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -105.18 3.44 30.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.956 0.408 . . . . 0.0 110.729 179.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.546 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 114.3 45.73 0.66 Allowed Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.641 ' HD1' HG23 ' A' ' 37' ' ' VAL . 83.1 t80 -138.25 130.43 28.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.874 0.369 . . . . 0.0 110.822 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.44 ' HB3' ' HD3' ' A' ' 36' ' ' LYS . 22.4 tt0 -144.95 157.32 44.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.006 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.626 HG23 ' HB3' ' A' ' 39' ' ' LEU . 58.2 mt -127.45 136.43 60.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.305 -171.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.558 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 50.0 t80 -123.52 102.1 7.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.499 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.593 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.1 mt-30 -93.74 141.97 27.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 111.578 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.5 mt -122.26 122.17 65.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.038 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.899 ' HA ' ' O ' ' A' ' 43' ' ' THR . 78.7 p -99.73 142.01 31.78 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -175.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.747 HD11 HD12 ' A' ' 114' ' ' LEU . 81.5 mt -110.71 31.54 5.91 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.249 0.547 . . . . 0.0 109.565 172.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.558 ' HA ' HG23 ' A' ' 44' ' ' VAL . 5.3 p-10 -73.1 144.64 46.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.184 -173.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -108.31 16.7 34.97 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 164.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -125.69 94.6 4.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.151 -1.024 . . . . 0.0 109.278 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.416 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 32.0 tt0 -72.89 -27.06 61.66 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.227 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 -72.68 -32.85 66.12 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.766 -174.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -79.09 -40.53 30.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.535 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 39.9 t90 -61.11 -48.92 79.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.632 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.54 ' HG3' HD11 ' A' ' 23' ' ' LEU . 35.9 ttmt -62.46 -44.36 96.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.887 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 p -75.19 -34.25 61.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.359 . . . . 0.0 111.633 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.641 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 21.8 t -73.04 -44.99 60.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.449 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -67.55 -24.52 65.54 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.208 -178.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -63.39 -38.41 91.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.43 0.633 . . . . 0.0 109.709 176.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -93.99 11.41 29.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.969 -177.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 86' ' ' SER . 20.1 mt -97.64 133.68 23.29 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-O 121.535 0.683 . . . . 0.0 112.294 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.648 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 57.7 Cg_endo -80.45 -31.55 1.55 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 124.312 3.341 . . . . 0.0 113.071 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.648 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.8 p90 -100.77 -167.0 1.37 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.967 -173.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.558 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 54.1 t -81.68 132.72 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.782 -175.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.449 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -136.65 100.04 4.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.062 179.4 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.624 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 14.5 m -114.87 151.25 16.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.474 -175.336 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -107.88 137.44 45.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 0.0 111.882 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -92.14 135.43 33.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.036 174.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.77 -4.34 57.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -94.6 -14.78 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.721 -174.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 49.36 66.5 2.2 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.838 174.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.565 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 77.55 -5.17 2.18 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.414 0.685 . . . . 0.0 112.845 175.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -101.01 12.91 36.8 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.467 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.7 OUTLIER -61.96 126.59 27.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.89 -175.77 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.6 m -55.41 -28.88 56.96 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.372 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -61.3 -38.93 88.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.842 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.467 HG13 ' HB2' ' A' ' 103' ' ' SER . 71.9 mt -59.66 -35.06 57.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.839 -178.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.7 m -73.86 -27.6 61.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.929 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.84 -37.81 67.31 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.089 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -77.34 -8.51 57.78 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 121.135 -0.226 . . . . 0.0 110.598 178.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.49 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER . . . . . 0 CA--C 1.516 -0.355 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -169.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.747 HD12 HD11 ' A' ' 76' ' ' LEU . 72.1 mt . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.671 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 14.2 Cg_exo -69.35 159.44 88.4 Favored 'Cis proline' 0 C--N 1.354 0.833 0 C-N-CA 124.597 -1.001 . . . . 0.0 113.802 1.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 67.9 m -153.07 174.41 14.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.739 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.9 p -142.15 155.71 19.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.612 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.3 m-85 -136.02 161.88 34.44 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.792 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.2 tp -111.76 133.48 53.96 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 4.2 t -131.29 128.41 61.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.854 0.359 . . . . 0.0 110.322 174.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.558 ' HB3' HD22 ' A' ' 143' ' ' LEU . 10.1 p30 -90.79 174.6 7.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.245 178.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -54.17 -23.23 13.58 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -166.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . 0.54 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 28.0 m-20 -83.82 9.86 10.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.649 0.261 . . . . 0.0 110.513 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.45 ' HB2' ' HD3' ' A' ' 34' ' ' LYS . 1.5 t-20 64.79 35.74 8.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.978 -174.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.54 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 43.9 mt-10 -109.48 138.04 46.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.025 -176.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.85 112.8 3.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.675 0.75 . . . . 0.0 110.85 176.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.792 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 45.7 m -78.01 -55.65 5.12 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.621 178.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.22 14.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.956 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.644 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 0.2 OUTLIER -99.31 159.37 15.05 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.218 178.649 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -55.69 -46.18 83.05 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 121.613 -0.327 . . . . 0.0 113.64 -175.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . 0.644 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.0 OUTLIER -71.78 -29.66 64.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.261 0.553 . . . . 0.0 110.018 179.765 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.459 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -68.33 -39.53 81.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.613 177.318 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.826 HG21 ' HG ' ' A' ' 136' ' ' LEU . 75.3 mt -70.71 147.36 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.535 178.33 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HE3' ' HB3' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -140.71 108.5 5.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 171.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.488 ' OD1' ' HB3' ' A' ' 137' ' ' ASP . 15.7 t70 67.7 102.31 0.05 OUTLIER 'General case' 0 C--O 1.233 0.202 0 O-C-N 124.432 1.083 . . . . 0.0 109.867 -168.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.826 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.8 mp -75.13 -22.24 58.31 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.69 -177.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.488 ' HB3' ' OD1' ' A' ' 135' ' ' ASP . 9.7 t70 -52.73 -53.87 41.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.18 175.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.654 ' HB3' ' HE2' ' A' ' 142' ' ' LYS . 33.1 mm-40 -56.98 -50.4 72.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.331 173.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -53.89 -54.27 41.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.174 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.86 HD12 HD12 ' A' ' 60' ' ' LEU . 31.0 mt -67.11 -33.54 63.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.043 0.449 . . . . 0.0 110.928 -177.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -65.21 -32.78 74.63 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.402 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.654 ' HE2' ' HB3' ' A' ' 138' ' ' GLU . 54.1 mttm -80.46 -20.45 43.73 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.95 177.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.558 HD22 ' HB3' ' A' ' 121' ' ' ASN . 65.5 mt -73.6 -43.05 60.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.901 177.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 91.9 mt . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.575 178.493 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.45 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 10.3 tt . . . . . 0 CA--C 1.535 0.38 0 CA-C-O 121.042 0.449 . . . . 0.0 111.913 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.674 ' H ' HD12 ' A' ' 16' ' ' ILE . 3.9 mp -74.75 103.79 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 173.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.79 108.17 9.63 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.1 mt -100.76 116.92 45.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.119 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.578 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 78.7 mt-30 -107.85 101.48 10.76 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.192 0.52 . . . . 0.0 110.82 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.838 ' HB2' HG11 ' A' ' 95' ' ' VAL . 29.6 mt -138.87 162.1 35.65 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.536 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 51.8 mttm -94.25 150.06 20.65 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.344 0.592 . . . . 0.0 111.435 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.57 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -81.24 -170.26 2.66 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.558 177.213 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.645 HD11 ' HE2' ' A' ' 84' ' ' LYS . 44.7 tp -54.82 -39.69 68.78 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.723 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 52.8 mttp -78.04 -26.95 48.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.445 -176.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 114.54 11.49 11.61 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.114 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.482 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 36.4 m-80 -82.79 110.45 17.83 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.536 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.3 m -68.27 113.55 5.98 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.521 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.6 mmm180 -103.42 139.58 38.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.037 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.578 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 82.4 p -120.48 160.3 23.42 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.585 HD12 ' O ' ' A' ' 16' ' ' ILE . 63.4 mt -80.55 -25.29 38.7 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.745 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.7 p -66.49 -20.17 65.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 173.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -79.28 -40.86 29.44 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 122.232 1.015 . . . . 0.0 108.476 175.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 tp -78.29 6.26 8.64 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.824 -1.534 . . . . 0.0 110.879 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.729 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.5 ttmm -73.96 114.96 12.85 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.344 -177.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.61 -25.41 2.29 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -173.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.653 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -117.77 168.24 10.64 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.438 175.75 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.756 HG23 ' HD1' ' A' ' 69' ' ' PHE . 29.4 m -82.92 124.58 39.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 173.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.68 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 72.3 t -113.05 136.92 47.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.565 0.698 . . . . 0.0 112.101 -168.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 39' ' ' LEU . 9.4 tp -98.99 119.18 37.33 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.624 177.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.407 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 0.2 OUTLIER -97.12 104.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.903 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -107.68 135.0 49.84 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.613 ' O ' ' HA ' ' A' ' 115' ' ' PRO . 82.9 m-85 -119.04 101.62 8.16 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 75' ' ' SER . 1.1 t -128.63 -178.21 4.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.186 -172.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.67 HG13 ' HB3' ' A' ' 47' ' ' ASN . 0.4 OUTLIER -135.79 117.6 20.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.265 177.456 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.501 ' OH ' HD11 ' A' ' 90' ' ' LEU . 32.0 m-85 -78.64 80.07 5.03 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.546 0.689 . . . . 0.0 110.689 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -179.67 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.757 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.67 ' HB3' HG13 ' A' ' 44' ' ' VAL . 4.6 t30 -77.51 132.71 38.51 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.562 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.05 -26.68 68.36 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.475 -173.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.91 -32.5 72.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.304 0.573 . . . . 0.0 109.603 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.3 m -68.22 -27.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.733 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.1 43.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.743 0.306 . . . . 0.0 111.042 -177.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.87 -34.09 76.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.48 . . . . 0.0 110.796 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.45 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 76.5 t60 -64.31 -38.75 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.578 ' HA ' HD12 ' A' ' 57' ' ' LEU . 6.2 m-20 -70.89 -18.83 62.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.615 -179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.2 tt -77.18 -41.75 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.025 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.76 82.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.373 0.606 . . . . 0.0 109.814 175.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.578 HD12 ' HA ' ' A' ' 54' ' ' ASN . 82.3 mt -65.36 -38.6 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.684 176.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.413 ' HA ' ' CZ3' ' A' ' 92' ' ' TRP . 5.9 tpp180 -61.89 -30.34 70.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.001 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -77.42 -51.61 10.5 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -174.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 140' ' ' ILE . 1.8 mm? -56.14 -29.79 61.24 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.675 -2.057 . . . . 0.0 111.625 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -78.71 -46.34 19.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.085 -177.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.35 -22.48 66.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.545 0.688 . . . . 0.0 110.68 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -82.86 -61.06 1.97 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.129 -0.941 . . . . 0.0 112.329 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.578 ' HB3' HD11 ' A' ' 144' ' ' LEU . 92.9 m-85 -112.24 -5.64 14.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -162.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.581 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.04 -36.94 75.87 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 m -70.22 -5.74 29.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.593 ' HB2' HD13 ' A' ' 144' ' ' LEU . 45.3 mt-30 -110.64 12.91 22.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.007 0.432 . . . . 0.0 111.292 -178.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.474 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 100.98 52.35 1.1 Allowed Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.786 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.756 ' HD1' HG23 ' A' ' 37' ' ' VAL . 43.3 t80 -131.12 134.34 46.47 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.653 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 10.6 tp10 -137.74 144.61 41.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.516 -177.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.426 HD12 ' CE3' ' A' ' 92' ' ' TRP . 60.3 mt -109.29 125.65 66.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.184 0.516 . . . . 0.0 110.426 177.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.521 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 85.6 t80 -111.0 102.02 10.53 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.54 -0.755 . . . . 0.0 108.974 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -95.31 134.45 38.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.252 -174.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.554 HD12 ' CE2' ' A' ' 42' ' ' PHE . 43.2 mt -120.11 112.16 35.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 0.0 110.059 174.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.418 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 30.1 t -91.11 140.66 29.61 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.7 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.645 HD11 HD12 ' A' ' 114' ' ' LEU . 16.6 mt -93.48 13.62 21.21 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.429 ' CG ' ' H ' ' A' ' 78' ' ' GLY . 5.2 p-10 44.13 -111.33 0.21 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.366 -1.288 . . . . 0.0 113.393 178.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.429 ' H ' ' CG ' ' A' ' 77' ' ' ASP . . . 92.75 -29.13 8.21 Favored Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 -170.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.73 119.51 11.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -72.58 -30.27 64.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.55 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -67.48 -57.07 7.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.391 -174.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -66.02 -38.31 88.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.397 -174.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.509 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 36.1 t90 -62.42 -48.11 81.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.645 ' HE2' HD11 ' A' ' 23' ' ' LEU . 3.2 ttmt -58.11 -54.89 41.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.488 -174.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -66.03 -33.74 76.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.916 -0.583 . . . . 0.0 112.194 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.532 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.2 t -83.38 -32.8 25.99 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.458 -177.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.422 ' HB3' HD22 ' A' ' 23' ' ' LEU . . . -75.82 -35.0 60.15 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.503 ' HB2' ' CD2' ' A' ' 23' ' ' LEU . 19.0 t70 -70.34 -28.46 65.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.035 -176.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -94.08 16.43 14.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.482 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' ' 94' ' ' CYS . 16.5 mt -88.71 148.32 41.42 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.36 0.6 . . . . 0.0 112.166 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.702 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.6 Cg_endo -76.04 -37.71 1.45 Allowed 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.693 2.929 . . . . 0.0 113.03 177.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.702 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 10.9 p90 -104.58 -167.91 1.41 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.778 -175.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.433 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 38.4 t -82.4 125.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.608 -175.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.572 ' HB2' HD12 ' A' ' 90' ' ' LEU . 30.8 t -121.91 108.78 13.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.241 0.543 . . . . 0.0 109.977 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.838 HG11 ' HB2' ' A' ' 20' ' ' LEU . 14.1 t -114.58 162.01 12.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.288 -172.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.438 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . 44.0 ttp180 -128.44 137.24 51.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 111.277 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -87.94 145.97 25.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.57 -24.64 45.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.089 0.471 . . . . 0.0 111.357 -176.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.54 32.18 5.7 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.917 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.489 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . -57.76 82.62 0.01 OUTLIER Glycine 0 C--N 1.342 0.876 0 O-C-N 123.757 0.66 . . . . 0.0 114.129 -173.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 167.24 -33.9 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.544 1.138 . . . . 0.0 108.561 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.92 12.07 5.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.97 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.52 ' HB3' HG13 ' A' ' 106' ' ' ILE . 41.9 t -62.99 135.85 57.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.604 -177.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.56 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.3 m -54.99 -37.24 66.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.13 -176.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -56.84 -56.48 21.07 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.301 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.52 HG13 ' HB3' ' A' ' 103' ' ' SER . 11.5 mt -58.61 -33.74 49.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.664 -175.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 18.6 m -71.01 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.427 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 104' ' ' SER . 94.6 mt -64.55 -34.96 79.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.751 0.31 . . . . 0.0 110.977 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -77.69 -4.11 44.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.895 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 t30 . . . . . 0 C--O 1.233 0.221 0 CA-C-O 121.883 0.849 . . . . 0.0 109.728 -174.423 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.645 HD12 HD11 ' A' ' 76' ' ' LEU . 36.2 mt . . . . . 0 C--O 1.232 0.175 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.613 ' HA ' ' O ' ' A' ' 42' ' ' PHE . 43.6 Cg_endo -68.25 150.16 85.55 Favored 'Cis proline' 0 C--N 1.347 0.462 0 C-N-CA 123.84 -1.317 . . . . 0.0 114.234 1.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.1 m -136.44 164.35 28.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.207 174.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 p -133.7 152.45 34.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.048 0.452 . . . . 0.0 110.68 -176.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.469 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 71.5 m-85 -133.77 152.1 51.78 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.356 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.633 HD13 HD11 ' A' ' 136' ' ' LEU . 35.4 tp -111.85 142.98 43.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.68 ' CG2' ' HB ' ' A' ' 38' ' ' VAL . 4.6 m -136.56 146.3 28.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 169.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.407 HD21 ' HB2' ' A' ' 125' ' ' GLU . 10.0 p30 -83.38 171.91 13.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -177.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 8.9 ptp180 -65.16 -11.81 44.38 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -168.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -80.55 6.48 12.38 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 172.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.729 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 2.2 t-20 56.21 53.88 8.43 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.988 -173.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.45 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 75.1 mm-40 -129.98 143.95 51.07 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.625 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.646 ' HA ' HG12 ' A' ' 120' ' ' VAL . 2.6 tt -57.07 119.33 6.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.284 0.564 . . . . 0.0 110.954 -172.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.86 -51.84 5.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.161 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.51 171.56 7.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -176.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.571 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -99.09 163.83 12.41 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.638 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.411 ' HA2' HD12 ' A' ' 133' ' ' ILE . . . -44.42 -42.52 7.2 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 -175.134 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -41.42 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 117.27 0.535 . . . . 0.0 110.948 -177.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -63.48 -27.97 69.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.167 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ILE . . . . . 0.833 HG21 HD22 ' A' ' 136' ' ' LEU . 90.0 mt -68.24 -33.28 59.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.604 178.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.602 ' NZ ' ' HB2' ' A' ' 134' ' ' LYS . 5.1 mtmp? 72.09 -55.3 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.444 0.698 . . . . 0.0 110.263 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -154.47 124.68 6.84 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.508 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.833 HD22 HG21 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -66.98 -42.98 84.16 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.678 -173.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.55 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.0 t70 -52.14 -51.28 58.92 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.107 0.479 . . . . 0.0 109.961 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.28 -50.54 50.09 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.4 175.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.494 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -71.6 -46.81 58.14 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -173.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ILE . . . . . 0.873 HD12 HD12 ' A' ' 60' ' ' LEU . 36.4 mt -59.04 -36.52 62.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 0.0 110.379 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -59.35 -49.47 77.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.451 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -75.51 -21.53 57.92 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.711 -178.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' LEU . . . . . 0.559 ' HB3' HG11 ' A' ' 37' ' ' VAL . 86.2 mt -69.59 -40.36 76.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.333 0.587 . . . . 0.0 110.436 175.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.593 HD13 ' HB2' ' A' ' 67' ' ' GLN . 73.2 mt . . . . . 0 C--N 1.324 -0.5 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.253 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.3 tpp . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 120.584 0.23 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.2 t -171.59 156.18 4.32 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.4 tp -98.57 99.36 10.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.971 0.415 . . . . 0.0 110.306 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.424 ' O ' ' HD3' ' A' ' 6' ' ' PRO . 9.4 tp10 -117.53 154.41 31.53 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.763 HG23 ' HB2' ' A' ' 13' ' ' ALA . 60.8 mt -107.31 96.9 16.96 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 120.771 0.319 . . . . 0.0 110.987 -177.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HD3' ' O ' ' A' ' 4' ' ' GLU . 35.7 Cg_endo -91.87 160.03 3.37 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.721 2.28 . . . . 0.0 111.791 176.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.908 ' HB3' ' HB3' ' A' ' 12' ' ' GLU . 12.0 pt-20 -159.03 163.77 36.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.578 -178.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.57 ' OD2' ' HG2' ' A' ' 9' ' ' LYS . 26.6 t70 173.31 -40.16 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 124.401 1.063 . . . . 0.0 109.854 175.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.57 ' HG2' ' OD2' ' A' ' 8' ' ' ASP . 42.9 mmtm -150.3 165.78 31.97 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.036 -1.438 . . . . 0.0 109.466 -175.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.0 mt 63.0 -90.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 O-C-N 123.8 0.687 . . . . 0.0 111.42 176.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.596 ' HG2' ' OE2' ' A' ' 12' ' ' GLU . 3.4 ttpp -153.28 148.0 26.31 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.688 177.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.908 ' HB3' ' HB3' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -77.92 151.23 33.86 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.601 177.177 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.763 ' HB2' HG23 ' A' ' 5' ' ' ILE . . . 53.59 41.73 32.03 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.252 0.549 . . . . 0.0 110.774 -178.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.08 -15.24 60.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.151 -175.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.9 tp -121.01 131.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.166 0.508 . . . . 0.0 111.122 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.52 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.9 mp -95.95 122.81 47.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.555 175.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.406 ' OD1' ' HB2' ' A' ' 29' ' ' SER . 26.2 t70 -87.08 106.17 17.68 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.69 ' O ' ' HA ' ' A' ' 29' ' ' SER . 13.0 mt -89.4 110.2 21.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.457 -173.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.523 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 34.3 mt-30 -105.59 100.03 9.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.196 0.522 . . . . 0.0 110.776 -178.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 97' ' ' ASP . 32.7 mt -140.22 151.01 44.84 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 174.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.684 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.9 mttm -90.89 155.34 18.82 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.084 -0.646 . . . . 0.0 111.037 -173.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 15.2 p30 -91.76 -172.6 3.26 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.436 -1.256 . . . . 0.0 111.03 -175.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.742 HD11 ' HA ' ' A' ' 84' ' ' LYS . 21.2 tp -57.31 -27.38 62.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.319 -175.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.571 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 68.0 mttm -96.05 -12.5 24.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.062 0.458 . . . . 0.0 111.026 -175.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.91 -3.34 31.86 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.38 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.571 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 17.9 m-80 -72.26 118.76 15.55 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.684 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.6 m -73.08 106.21 4.85 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.209 -177.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.438 ' HA ' ' HD3' ' A' ' 28' ' ' ARG . 16.5 mmt180 -87.81 142.14 28.05 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.742 -177.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.69 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 31.9 p -135.33 159.76 40.55 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 174.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.912 ' HB3' HD21 ' A' ' 124' ' ' ASN . 47.0 mt -72.72 -21.35 61.05 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.446 0.641 . . . . 0.0 110.004 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.411 ' HA ' ' NZ ' ' A' ' 34' ' ' LYS . 3.6 p -73.17 -15.5 61.45 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.144 172.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.437 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t70 -87.37 -40.12 14.7 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.751 0.786 . . . . 0.0 109.467 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.683 HD23 HG13 ' A' ' 38' ' ' VAL . 7.8 tp -86.6 15.81 5.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.281 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.6 ' HB2' ' HZ2' ' A' ' 34' ' ' LYS . 4.4 ttmp? -66.76 -11.17 53.76 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.332 0.587 . . . . 0.0 111.517 -177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -67.21 -20.58 71.32 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.625 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.669 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 76.7 mttt -129.95 178.8 6.26 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 178.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.791 HG23 ' HD1' ' A' ' 69' ' ' PHE . 19.6 m -81.02 129.0 38.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 166.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.683 HG13 HD23 ' A' ' 33' ' ' LEU . 24.1 t -101.68 121.62 52.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 121.123 0.487 . . . . 0.0 111.868 -168.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.407 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 14.5 tp -88.41 116.18 26.46 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.366 173.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.557 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 10.0 mm -90.08 105.25 16.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.497 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 10.3 t70 -106.99 130.3 54.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.922 0.391 . . . . 0.0 110.902 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.699 ' HB3' HD11 ' A' ' 76' ' ' LEU . 66.5 m-85 -121.3 100.74 7.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.839 176.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.0 t -146.64 176.39 9.87 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.625 -178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.507 ' HB ' ' HB3' ' A' ' 77' ' ' ASP . 5.2 m -111.06 119.49 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.135 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.728 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 43.8 m-85 -74.42 83.52 1.96 Allowed 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 173.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 177.45 -39.07 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.933 0.873 . . . . 0.0 109.791 -168.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.448 ' HB2' HG23 ' A' ' 44' ' ' VAL . 9.0 t-20 -95.04 142.52 27.42 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.06 -1.427 . . . . 0.0 110.837 -167.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.78 -29.53 66.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.437 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.9 ptp -65.98 -22.08 66.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.011 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 t -73.33 -29.73 62.87 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -178.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.54 -52.17 62.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.119 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.26 -37.0 80.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.746 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.471 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 78.6 t60 -64.84 -36.79 85.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.394 178.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.558 ' HA ' HD12 ' A' ' 57' ' ' LEU . 21.5 t-20 -67.17 -32.14 73.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.751 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tt -65.45 -42.74 92.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.972 0.415 . . . . 0.0 109.925 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.87 77.3 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.298 0.57 . . . . 0.0 110.368 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.558 HD12 ' HA ' ' A' ' 54' ' ' ASN . 62.7 mt -69.03 -40.46 78.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.757 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 58' ' ' ARG . 9.3 tpt180 -60.48 -30.12 69.5 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.192 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -76.4 -52.03 10.69 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.849 HD12 HD12 ' A' ' 140' ' ' ILE . 2.2 mm? -57.43 -27.84 62.76 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 112.681 -2.054 . . . . 0.0 111.415 178.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -76.29 -46.57 27.21 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.007 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.4 -22.18 65.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.247 0.546 . . . . 0.0 110.547 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.543 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 37.3 mttm -77.39 -61.16 2.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.035 -179.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 141' ' ' LYS . 95.8 m-85 -115.17 -8.05 12.4 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -164.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.565 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.89 -36.05 76.14 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.176 0.444 . . . . 0.0 111.491 -176.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.0 m -64.43 -19.99 65.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.646 -178.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -102.98 2.39 34.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.678 0.275 . . . . 0.0 111.267 -176.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 112.54 55.58 0.46 Allowed Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.567 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.791 ' HD1' HG23 ' A' ' 37' ' ' VAL . 31.4 t80 -131.54 143.33 50.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.669 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.75 148.24 38.66 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.976 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.536 HD13 ' HB3' ' A' ' 57' ' ' LEU . 56.9 mt -107.69 117.86 54.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.144 0.497 . . . . 0.0 110.066 176.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -99.32 99.32 10.25 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 43.9 tt0 -102.45 123.77 46.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.14 -172.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 49.6 mt -105.69 125.24 61.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.612 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.728 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 4.0 p -84.95 121.91 28.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.786 176.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.699 HD11 ' HB3' ' A' ' 42' ' ' PHE . 16.8 mt -106.52 5.74 29.48 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.284 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.509 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.1 p-10 -68.81 -60.93 2.04 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.162 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.1 5.55 32.73 Favored Glycine 0 N--CA 1.443 -0.886 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 -178.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.478 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 33.8 t70 -113.16 104.18 12.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.375 0.607 . . . . 0.0 110.728 -178.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 31.0 mt-10 -68.78 -14.35 62.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.934 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . 0.478 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 61.0 m80 -66.49 -59.35 3.73 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 120.641 -0.423 . . . . 0.0 110.624 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -74.43 -34.46 63.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.276 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -60.8 -53.38 58.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.955 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.742 ' HA ' HD11 ' A' ' 23' ' ' LEU . 19.3 ttmt -63.87 -41.62 97.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.689 0.281 . . . . 0.0 111.391 -173.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -69.75 -41.46 75.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.84 0.353 . . . . 0.0 111.548 -177.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -75.54 -47.56 26.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.369 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.655 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -67.79 -27.16 66.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.833 -174.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -58.54 -27.26 64.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.25 0.548 . . . . 0.0 111.429 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -108.67 13.0 25.44 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.773 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.7 mt -90.37 144.69 31.27 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 111.718 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.627 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 60.5 Cg_endo -70.25 -52.81 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.688 2.925 . . . . 0.0 113.518 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.627 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.8 p90 -87.41 -169.02 2.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.144 -171.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.8 t -80.96 126.83 39.83 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.849 -173.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.655 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 2.0 p -123.73 108.65 12.76 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.508 -178.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 19.7 m -121.43 172.17 8.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.233 -178.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 44.1 ttp180 -125.57 144.36 50.6 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.984 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.49 ' HA ' HD13 ' A' ' 20' ' ' LEU . 19.8 t70 -81.6 168.74 17.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.903 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.28 -38.33 27.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.252 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.424 ' CG ' ' HB2' ' A' ' 102' ' ' TYR . 7.3 t-20 -122.97 -11.77 8.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.008 0.432 . . . . 0.0 111.339 -175.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.552 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 78.64 -108.91 2.74 Favored Glycine 0 N--CA 1.441 -0.968 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.472 176.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.01 -23.94 64.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.079 0.466 . . . . 0.0 110.858 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.424 ' HB2' ' CG ' ' A' ' 99' ' ' ASN . 55.6 m-85 -99.08 29.16 4.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.804 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.488 ' HB3' HG13 ' A' ' 106' ' ' ILE . 37.1 t -60.15 140.0 57.19 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.507 -178.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.562 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.5 m -63.36 -31.26 72.37 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.745 174.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -67.19 -48.82 66.76 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.995 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.9 HG23 HG13 ' A' ' 111' ' ' VAL . 58.9 mt -53.71 -38.03 33.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.623 175.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 20.4 m -68.61 -39.56 80.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.742 177.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.8 mt -68.59 -38.72 80.9 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.62 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.536 ' OH ' HD11 ' A' ' 18' ' ' ILE . 89.1 m-85 -69.8 -30.56 68.13 Favored 'General case' 0 CA--C 1.517 -0.299 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.818 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.35 45.82 4.74 Favored 'General case' 0 N--CA 1.461 0.121 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -165.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.9 HG13 HG23 ' A' ' 106' ' ' ILE . 1.5 p -79.85 -46.62 22.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.27 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 30.7 m 71.77 -53.72 0.68 Allowed 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 170.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.478 HD22 ' C ' ' A' ' 113' ' ' ASN . 0.2 OUTLIER -67.24 -80.04 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 -170.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.464 HD22 HG22 ' A' ' 111' ' ' VAL . 3.6 mm? 67.41 143.19 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 123.043 0.537 . . . . 0.0 111.708 -176.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.462 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 52.7 Cg_endo -70.56 162.09 87.1 Favored 'Cis proline' 0 C--N 1.346 0.443 0 C-N-CA 123.239 -1.567 . . . . 0.0 111.716 -0.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.6 t -147.89 176.66 9.97 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.221 0.534 . . . . 0.0 110.748 -176.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.509 HG12 ' HA3' ' A' ' 130' ' ' GLY . 2.8 p -142.82 154.7 17.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 175.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.557 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.3 m-85 -143.3 158.17 43.86 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.965 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.5 tp -112.33 143.87 42.7 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.64 -173.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.531 HG11 HD22 ' A' ' 124' ' ' ASN . 2.8 t -140.95 131.69 27.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.035 172.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.584 ' HB3' HD22 ' A' ' 143' ' ' LEU . 3.9 p-10 -96.62 176.98 5.81 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.366 176.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.456 ' N ' HG12 ' A' ' 37' ' ' VAL . 84.0 mtt-85 -43.33 -42.56 4.59 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -166.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.561 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 75.3 m-20 -78.95 12.73 2.04 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 121.995 -0.441 . . . . 0.0 110.457 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.912 HD21 ' HB3' ' A' ' 30' ' ' LEU . 2.3 t-20 61.18 44.12 10.32 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.487 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.561 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 87.4 mt-10 -96.23 133.13 40.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.837 -1.074 . . . . 0.0 109.288 177.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.7 tt -72.34 107.94 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.965 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 63.8 m -71.66 -55.49 7.62 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.291 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 178.95 173.04 0.77 Allowed 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.037 -177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.579 ' HD3' ' OE2' ' A' ' 131' ' ' GLU . 76.4 mtt180 -83.3 159.28 21.93 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.745 176.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.509 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -62.81 -34.33 89.47 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 111.747 -0.541 . . . . 0.0 111.747 175.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.579 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 2.0 mp0 -64.19 -25.39 68.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.248 0.547 . . . . 0.0 110.356 177.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -90.69 -26.86 19.36 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.315 0.579 . . . . 0.0 110.194 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.588 ' CD1' ' HB2' ' A' ' 119' ' ' LEU . 23.4 mt -99.11 94.79 3.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.147 -175.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.17 11.71 24.67 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.227 173.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -143.43 41.4 1.47 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.283 -170.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.577 ' HA ' ' HB3' ' A' ' 139' ' ' ALA . 3.7 mp -53.66 -35.37 60.95 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -176.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.582 ' HA ' HD11 ' A' ' 60' ' ' LEU . 24.0 t70 -54.53 -58.41 7.58 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.738 0.304 . . . . 0.0 110.551 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.607 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 4.4 mm-40 -65.68 -32.61 74.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 111.916 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.716 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.68 -56.01 24.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.618 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.849 HD12 HD12 ' A' ' 60' ' ' LEU . 48.2 mt -61.47 -34.98 63.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.143 0.497 . . . . 0.0 110.108 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 64' ' ' TYR . 25.6 tttm -60.0 -53.41 58.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.896 176.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 138' ' ' GLU . 13.8 pttm -67.27 -27.34 67.12 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -177.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 48.3 mt -64.22 -42.12 96.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.669 0.747 . . . . 0.0 110.027 175.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.423 HD22 ' NH2' ' A' ' 122' ' ' ARG . 88.0 mt -71.02 -32.73 69.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.987 178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.493 ' HB3' ' NE2' ' A' ' 148' ' ' HIS . 29.8 mt-10 -62.25 -6.83 3.44 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -57.49 -17.82 27.54 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 120.388 -0.911 . . . . 0.0 111.985 173.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -64.17 -28.12 69.54 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . 0.493 ' NE2' ' HB3' ' A' ' 145' ' ' GLU . 14.7 p80 -89.7 57.94 4.09 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.507 -178.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 37.9 m80 52.43 58.83 4.98 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.77 175.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.548 ' HB3' ' H ' ' A' ' 152' ' ' HIS . 0.0 OUTLIER -175.98 -164.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 -176.343 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.462 ' O ' ' HB3' ' A' ' 152' ' ' HIS . 3.1 t60 -111.19 -3.86 15.23 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 169.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . 0.548 ' H ' ' HB3' ' A' ' 150' ' ' HIS . 26.3 p80 . . . . . 0 C--O 1.249 1.076 0 CA-C-N 113.874 -1.512 . . . . 0.0 107.769 173.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.717 0.294 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.1 m -151.96 -67.42 0.17 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.9 tp -153.46 68.06 0.78 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.418 0.628 . . . . 0.0 109.815 177.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -90.58 143.02 27.15 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.925 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.445 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 58.2 mt -99.0 113.14 64.34 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.423 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.536 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 6.9 Cg_exo -76.86 -131.91 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 123.713 2.942 . . . . 0.0 112.696 179.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -48.69 136.64 13.18 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.658 -0.701 . . . . 0.0 112.128 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -82.16 75.23 9.1 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 171.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.711 ' HB3' ' NZ ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER 175.61 125.09 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.998 -1.001 . . . . 0.0 108.684 -176.644 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.599 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 43.3 mm -49.99 103.99 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 O-C-N 123.828 0.705 . . . . 0.0 111.984 -176.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.599 ' HB2' ' O ' ' A' ' 10' ' ' ILE . 9.1 ttpp 153.84 4.7 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.124 1.37 . . . . 0.0 108.617 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -74.55 -25.02 59.03 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.531 -172.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.74 2.17 10.68 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.801 -176.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.7 m -147.13 76.24 1.41 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.783 0.325 . . . . 0.0 111.67 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.516 HG21 ' O ' ' A' ' 124' ' ' ASN . 9.4 pt 42.5 -159.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 124.74 1.275 . . . . 0.0 113.392 172.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.553 ' O ' HD12 ' A' ' 30' ' ' LEU . 79.5 mt -121.66 103.52 13.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 174.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -104.23 130.81 52.0 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.527 HG22 ' HG ' ' A' ' 20' ' ' LEU . 14.6 mt -116.76 121.47 67.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.228 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.558 ' HG3' ' HB3' ' A' ' 29' ' ' SER . 1.7 mp0 -98.08 101.75 13.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.808 -0.178 . . . . 0.0 110.732 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.527 ' HG ' HG22 ' A' ' 18' ' ' ILE . 33.7 mt -132.03 155.6 47.74 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 50.7 mttm -86.94 151.07 23.62 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.934 0.397 . . . . 0.0 110.793 178.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.643 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -85.39 -177.53 6.49 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.404 175.075 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.876 HD21 ' HB3' ' A' ' 87' ' ' ALA . 1.0 OUTLIER -53.89 -36.73 63.01 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.546 0.689 . . . . 0.0 112.005 179.346 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HB2' HD22 ' A' ' 26' ' ' ASN . 39.5 mttp -78.22 -18.91 54.8 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.718 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 107.69 9.28 28.97 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.474 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.466 HD22 ' HB2' ' A' ' 24' ' ' LYS . 42.5 m-80 -81.57 108.86 15.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.479 0.18 . . . . 0.0 110.899 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.625 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 62.6 m -68.32 110.22 3.98 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.482 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 5.8 mmm180 -104.38 130.71 52.23 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.991 0.424 . . . . 0.0 110.329 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.558 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 45.7 p -104.31 159.04 16.04 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 169.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 16' ' ' ILE . 50.7 mt -69.6 -26.0 64.24 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.487 178.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.4 p -68.55 -16.29 63.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.73 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.502 ' HB3' ' O ' ' A' ' 29' ' ' SER . 0.3 OUTLIER -78.55 -24.83 45.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 122.295 1.045 . . . . 0.0 108.913 176.788 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.606 HD23 HG13 ' A' ' 38' ' ' VAL . 1.5 tp -99.18 6.08 46.54 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.133 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.515 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 51.0 tttm -69.77 144.53 52.67 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -176.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.73 -21.46 43.79 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 1.104 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 10.0 ttmt -124.07 155.8 37.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.425 -0.887 . . . . 0.0 108.859 178.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.793 HG23 ' HD1' ' A' ' 69' ' ' PHE . 26.9 m -81.59 140.3 16.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -176.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.606 HG13 HD23 ' A' ' 33' ' ' LEU . 32.2 t -122.56 129.02 75.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.27 0.557 . . . . 0.0 111.9 -169.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.603 HD22 HG23 ' A' ' 71' ' ' ILE . 7.0 tt -91.65 112.62 24.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.035 172.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.586 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 15.7 mm -91.03 105.75 16.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.235 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -109.67 139.77 44.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.987 0.423 . . . . 0.0 111.244 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -125.5 102.43 7.38 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.467 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.9 t -139.63 164.33 30.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.989 0.423 . . . . 0.0 111.62 -174.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.646 HG12 ' HA ' ' A' ' 77' ' ' ASP . 3.3 m -106.47 126.68 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.243 176.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.558 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 21.5 m-85 -87.8 83.42 7.13 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 -177.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.527 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 3.9 m-20 177.14 -50.03 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 114.666 -1.152 . . . . 0.0 108.585 -177.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.595 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.1 t30 -70.26 133.13 46.71 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.285 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.88 -24.63 38.29 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.557 -173.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 63.6 mtt -59.76 -26.69 65.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.851 177.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -75.8 -40.97 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.432 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.47 -59.25 5.26 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.771 -175.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.89 71.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.218 0.532 . . . . 0.0 110.707 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.496 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 t60 -65.19 -45.37 85.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.793 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.512 ' HA ' HD12 ' A' ' 57' ' ' LEU . 89.5 m-20 -69.07 -25.21 64.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.154 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.6 tt -73.09 -44.9 59.79 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.52 -35.34 74.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.36 0.6 . . . . 0.0 110.03 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -67.07 -37.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.867 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.424 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 10.1 tpp180 -60.95 -28.31 68.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.497 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -77.99 -53.75 7.07 Favored 'General case' 0 CA--C 1.494 -1.193 0 CA-C-O 122.666 1.222 . . . . 0.0 107.879 -177.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.757 HD12 HD12 ' A' ' 140' ' ' ILE . 2.4 mm? -55.36 -29.1 57.74 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 112.282 -2.235 . . . . 0.0 111.506 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -75.54 -48.29 23.11 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.912 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -61.71 -21.89 64.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.251 0.548 . . . . 0.0 110.431 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -80.35 -57.57 3.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.319 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -108.17 -5.59 16.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -167.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.514 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -70.63 178.69 2.9 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.867 178.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.5 m 71.61 -35.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.326 0.65 . . . . 0.0 111.602 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.42 ' H ' ' C ' ' A' ' 65' ' ' ALA . 50.6 mt-30 -79.45 -0.49 33.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.886 0.374 . . . . 0.0 111.114 178.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.589 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 110.71 47.53 0.78 Allowed Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.907 -0.664 . . . . 0.0 111.896 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.793 ' HD1' HG23 ' A' ' 37' ' ' VAL . 65.4 t80 -129.57 141.2 51.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.55 0.214 . . . . 0.0 110.872 -179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 1.104 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.1 tp10 -137.38 153.32 50.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.14 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.603 HG23 HD22 ' A' ' 39' ' ' LEU . 47.8 mt -111.9 124.77 68.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 173.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.1 t80 -109.69 100.92 9.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.204 0.526 . . . . 0.0 109.884 -177.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.727 ' HB2' ' HA ' ' A' ' 94' ' ' CYS . 15.9 mm100 -83.33 125.97 32.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.263 -178.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.8 mt -111.71 111.1 34.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 43' ' ' THR . 53.5 p -92.62 115.03 27.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.98 0.419 . . . . 0.0 110.815 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.622 HD11 HD22 ' A' ' 114' ' ' LEU . 0.5 OUTLIER -109.21 29.05 7.88 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.099 0.476 . . . . 0.0 110.106 177.507 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.646 ' HA ' HG12 ' A' ' 44' ' ' VAL . 16.8 t70 -73.41 -77.67 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.572 179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 139.17 -31.13 2.38 Favored Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.872 -178.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -81.61 135.97 35.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.165 0.507 . . . . 0.0 111.763 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -79.34 -52.14 8.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.963 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -66.71 -29.7 69.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -165.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.402 ' CD2' ' HA ' ' A' ' 46' ' ' ASN . 17.6 t80 -88.63 -40.05 13.61 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.48 ' CZ2' ' HG ' ' A' ' 23' ' ' LEU . 28.5 t90 -57.51 -47.62 81.46 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.326 172.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.664 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 14.2 mtpp -65.66 -47.71 74.61 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -176.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 8.5 p -63.92 -38.52 91.38 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.318 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.445 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 16.8 m -78.71 -42.72 27.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.135 -177.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.876 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -88.53 -33.46 17.74 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -169.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 2.0 t0 -73.43 -12.19 60.72 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 110.017 -174.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -101.99 13.49 34.61 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.011 173.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 87' ' ' ALA . 53.6 mt -96.69 150.33 36.84 Favored Pre-proline 0 N--CA 1.447 -0.592 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.525 177.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.736 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.2 Cg_endo -74.02 -42.39 0.77 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.991 3.127 . . . . 0.0 113.125 -177.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.736 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.7 p90 -90.15 -167.43 1.84 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.37 -171.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.401 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 49.0 t -81.69 130.79 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.158 -174.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.727 ' HA ' ' HB2' ' A' ' 73' ' ' GLN . 53.1 m -133.52 102.13 5.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.889 0.376 . . . . 0.0 110.233 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.643 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.0 m -114.15 173.25 3.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.761 -175.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -124.34 136.19 53.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.785 0.326 . . . . 0.0 111.611 -177.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -72.35 140.08 48.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.396 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.32 -25.46 33.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.937 -0.574 . . . . 0.0 112.1 -174.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -97.75 -12.33 22.39 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.861 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 61.78 66.07 2.85 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.616 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.53 ' HB2' HD12 ' A' ' 76' ' ' LEU . . . 77.81 -16.11 0.69 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.397 0.679 . . . . 0.0 111.749 177.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -92.05 19.47 6.76 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.208 0.528 . . . . 0.0 109.712 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.509 ' HB3' HG13 ' A' ' 106' ' ' ILE . 9.2 t -72.81 129.76 38.91 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.123 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.458 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 3.8 p -62.09 -30.88 71.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.458 -177.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.481 ' HA ' HD12 ' A' ' 108' ' ' LEU . 55.6 m-85 -61.55 -34.54 75.74 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.518 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.525 HG22 HG11 ' A' ' 111' ' ' VAL . 65.6 mt -58.92 -39.28 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.0 0.429 . . . . 0.0 110.478 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.3 m -74.36 -29.06 61.41 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 177.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.481 HD12 ' HA ' ' A' ' 105' ' ' TYR . 94.9 mt -70.57 -25.35 63.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.209 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.457 ' HB3' ' CE2' ' A' ' 118' ' ' PHE . 68.4 m-85 -77.54 -12.81 60.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.23 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.424 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER 60.08 55.48 3.71 Favored 'General case' 0 N--CA 1.462 0.15 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -171.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.525 HG11 HG22 ' A' ' 106' ' ' ILE . 14.2 p -71.89 134.38 30.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.578 -178.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 6.1 m -98.59 -31.81 11.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.057 0.456 . . . . 0.0 110.983 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 116' ' ' SER . 36.1 t-20 -152.7 142.07 21.61 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 -178.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.696 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 2.4 tt -144.43 145.26 28.28 Favored Pre-proline 0 CA--C 1.538 0.499 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -178.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.696 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 44.3 Cg_exo -51.22 144.04 8.78 Favored 'Cis proline' 0 C--N 1.362 1.261 0 CA-C-N 120.022 1.043 . . . . 0.0 114.079 2.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 113' ' ' ASN . 4.9 t -139.05 175.33 9.65 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.799 -173.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.653 HG11 HD11 ' A' ' 136' ' ' LEU . 9.3 p -142.32 152.54 18.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.822 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.63 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 84.1 m-85 -137.81 161.31 36.91 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 1.007 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.5 tp -110.9 136.76 49.45 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.802 -174.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 2.9 t -137.85 122.95 24.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 172.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.593 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 10.3 p30 -87.57 176.07 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 119.963 -0.695 . . . . 0.0 109.728 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.56 ' NH2' ' HA ' ' A' ' 147' ' ' HIS . 22.9 ptt-85 -64.12 -9.79 18.69 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -165.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.54 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 66.4 t30 -88.36 7.32 33.09 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.452 -0.78 . . . . 0.0 109.518 174.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.516 ' O ' HG21 ' A' ' 15' ' ' ILE . 0.1 OUTLIER 74.83 24.45 1.6 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.914 -178.176 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.593 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 84.7 mt-10 -91.45 116.05 28.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.576 -172.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 126' ' ' LEU . 1.6 tm? -59.56 107.66 0.62 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.584 0.707 . . . . 0.0 109.228 174.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 1.007 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.4 m -80.99 -56.62 3.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.41 -173.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.25 18.82 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.486 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.63 ' HG3' ' CE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -104.26 167.49 9.72 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.963 178.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.09 51.17 Favored Glycine 0 CA--C 1.52 0.395 0 N-CA-C 114.546 0.579 . . . . 0.0 114.546 -174.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.0 -21.7 46.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.286 0.543 . . . . 0.0 110.328 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.432 ' HB2' ' H ' ' A' ' 129' ' ' ARG . 0.9 OUTLIER -71.5 -36.17 71.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.693 173.772 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 119' ' ' LEU . 96.3 mt -69.53 129.86 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.831 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.99 95.61 5.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 174.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 11.3 t0 69.22 117.53 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 O-C-N 124.175 0.922 . . . . 0.0 111.185 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.653 HD11 HG11 ' A' ' 117' ' ' VAL . 14.9 mt -75.83 -25.76 56.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.443 -177.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.647 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.5 t70 -60.73 -41.1 94.65 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -70.8 -36.38 72.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.672 172.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.492 ' HB3' ' HA ' ' A' ' 136' ' ' LEU . . . -65.37 -53.35 44.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.921 0.391 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.757 HD12 HD12 ' A' ' 60' ' ' LEU . 55.6 mt -60.34 -40.91 85.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.145 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.703 ' O ' ' HG2' ' A' ' 145' ' ' GLU . 64.6 tttp -58.35 -48.75 79.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -66.32 -20.04 65.98 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.961 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.714 HD21 ' HG ' ' A' ' 119' ' ' LEU . 66.7 mt -66.83 -39.85 87.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.413 0.625 . . . . 0.0 109.866 172.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.516 ' HA ' HH12 ' A' ' 122' ' ' ARG . 96.2 mt -76.5 -47.32 23.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.737 177.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.703 ' HG2' ' O ' ' A' ' 141' ' ' LYS . 3.5 mm-40 -70.19 -20.7 63.1 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.984 -176.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -72.7 55.81 1.69 Allowed Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . 0.56 ' HA ' ' NH2' ' A' ' 122' ' ' ARG . 1.1 p-80 -74.46 72.71 1.88 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.187 -0.506 . . . . 0.0 111.926 -176.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 29.1 p80 -90.64 5.66 47.1 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.35 145.21 0.17 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.345 -1.298 . . . . 0.0 108.145 173.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 67.47 111.7 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 O-C-N 123.644 0.59 . . . . 0.0 109.851 -173.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 48.2 t60 -61.23 135.64 57.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.384 0.611 . . . . 0.0 111.895 -175.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 . . . . . 0 C--O 1.245 0.855 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 164.411 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.669 0.271 . . . . 0.0 110.651 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -65.99 131.73 46.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.453 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.5 tp -145.21 129.88 18.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.165 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -93.84 139.6 30.68 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.8 mt -129.73 97.93 23.24 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.874 0.369 . . . . 0.0 110.427 -177.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -87.9 -166.12 0.26 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.556 2.838 . . . . 0.0 113.132 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -61.56 -54.81 38.12 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.963 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -81.79 176.01 9.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.959 -177.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.45 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 32.2 mmtm -125.62 -154.72 0.64 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.385 -177.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.5 mm 63.78 -77.43 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.52 -0.208 0 CA-C-O 121.281 0.563 . . . . 0.0 110.947 -171.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.627 ' HD2' ' O ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -158.45 -14.29 0.07 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.736 175.363 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.4 ' H ' ' H ' ' A' ' 11' ' ' LYS . 25.5 mm-40 -81.75 178.93 8.04 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.526 -167.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.05 26.2 16.16 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 114.826 -1.079 . . . . 0.0 109.273 -167.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.93 -11.35 5.44 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.124 -176.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.676 HD11 HD13 ' A' ' 30' ' ' LEU . 15.3 tt -161.85 144.58 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.194 175.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.566 ' O ' HD12 ' A' ' 30' ' ' LEU . 4.0 mp -87.65 112.66 23.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -71.3 108.56 4.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.175 0.512 . . . . 0.0 109.868 -177.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.404 HG12 ' CE1' ' A' ' 105' ' ' TYR . 8.5 mt -101.43 114.93 42.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.043 -178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.574 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 79.2 mt-30 -105.58 101.11 10.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.869 -178.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.5 mt -132.22 158.28 42.16 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.193 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 26' ' ' ASN . 54.1 mttm -88.73 145.59 25.54 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.884 0.373 . . . . 0.0 111.536 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.559 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 25.9 m-20 -69.06 -177.0 0.96 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.263 174.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.536 HD23 ' SG ' ' A' ' 94' ' ' CYS . 3.5 pp -61.7 -28.48 69.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.972 0.891 . . . . 0.0 109.14 168.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.586 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 9.2 mtpm? -79.0 -7.18 57.86 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.078 -1.419 . . . . 0.0 112.024 176.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' ' 21' ' ' LYS . . . 81.93 16.04 73.53 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.947 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.559 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 11.6 m-20 -80.91 108.45 14.59 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.46 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.2 m -68.48 107.56 2.95 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.613 175.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.507 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -100.76 131.21 46.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.145 -178.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.574 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 24.5 p -102.36 161.66 13.53 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 170.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.676 HD13 HD11 ' A' ' 15' ' ' ILE . 51.1 mt -80.29 -29.02 38.17 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.556 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 p -67.5 -8.34 32.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.392 175.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -90.29 -45.14 9.24 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.471 ' CD1' ' HG2' ' A' ' 70' ' ' GLU . 1.4 mm? -67.5 -11.87 58.98 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 113.89 -1.505 . . . . 0.0 111.364 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 124' ' ' ASN . 8.7 ttpp -57.26 101.74 0.07 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.024 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 162.81 -39.95 0.35 Allowed Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 109.806 -1.317 . . . . 0.0 109.806 -177.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.678 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 98.9 mttt -100.95 174.01 6.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 171.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.565 HG13 ' HD1' ' A' ' 69' ' ' PHE . 3.4 p -83.43 118.64 31.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 167.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.22 124.58 55.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.289 -167.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.465 HD11 ' CD2' ' A' ' 136' ' ' LEU . 12.2 tp -93.04 107.58 19.34 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.205 177.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.606 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.8 mm -84.73 106.54 14.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.585 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 28.8 t0 -101.62 129.8 47.82 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.883 -177.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -120.97 97.93 5.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.022 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.414 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -148.95 164.8 33.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.013 0.435 . . . . 0.0 111.573 -178.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 76' ' ' LEU . 5.1 m -97.3 144.77 10.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.872 178.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.688 ' H ' ' HB3' ' A' ' 77' ' ' ASP . 7.3 m-85 -105.98 78.44 1.32 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.602 0.715 . . . . 0.0 110.436 172.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -163.15 16.82 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -144.48 131.88 20.85 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.171 -158.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -31.02 72.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.061 -175.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.14 -24.76 68.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.012 0.434 . . . . 0.0 110.973 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.3 m -74.76 -27.3 60.28 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.094 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.52 -38.3 68.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.153 0.501 . . . . 0.0 110.231 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.07 -25.89 61.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.527 0.679 . . . . 0.0 109.802 174.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.53 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 80.7 t60 -75.32 -47.55 27.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.197 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.658 ' HA ' HD12 ' A' ' 57' ' ' LEU . 33.7 p30 -73.76 -21.28 60.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.86 0.362 . . . . 0.0 110.889 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.31 -57.49 12.68 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.804 172.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.07 75.13 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.36 -0.837 . . . . 0.0 110.664 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.0 mt -63.21 -41.25 99.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.935 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -63.25 -31.43 72.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.329 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -74.48 -55.11 6.32 Favored 'General case' 0 CA--C 1.493 -1.215 0 CA-C-O 122.789 1.281 . . . . 0.0 108.041 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.75 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.0 -30.89 60.46 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.565 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -76.93 -46.25 24.94 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -62.61 -22.13 66.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.802 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -77.98 -61.61 1.94 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.194 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.564 ' OH ' ' HE3' ' A' ' 141' ' ' LYS . 96.3 m-85 -108.57 -1.43 19.65 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -164.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.431 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -68.01 170.22 8.7 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.438 176.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 25.2 m 71.5 -38.43 0.42 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.119 0.567 . . . . 0.0 111.08 -174.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' A' ' 65' ' ' ALA . 61.1 mt-30 -71.01 -9.81 58.66 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.457 0.646 . . . . 0.0 110.514 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.425 ' O ' HG12 ' A' ' 37' ' ' VAL . . . 117.7 34.36 1.18 Allowed Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.201 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.565 ' HD1' HG13 ' A' ' 37' ' ' VAL . 82.0 t80 -112.36 142.11 45.28 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 177.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.678 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.2 tp10 -143.17 155.34 44.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 178.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.504 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 54.7 mt -123.11 126.16 73.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.176 0.513 . . . . 0.0 109.993 175.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.553 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 78.6 t80 -112.08 100.87 9.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 176.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.585 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 31.2 tt0 -98.28 129.21 44.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.679 -175.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.408 HD11 ' HE2' ' A' ' 72' ' ' TYR . 57.2 mt -109.31 120.1 59.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.847 175.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 89.7 p -89.48 125.81 35.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.48 0.657 . . . . 0.0 110.336 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.423 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 14.3 mt -102.46 32.81 3.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 175.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.688 ' HB3' ' H ' ' A' ' 45' ' ' TYR . 4.6 p-10 -73.03 177.98 4.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.393 -168.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.89 26.03 4.57 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.082 -0.963 . . . . 0.0 112.011 176.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -162.89 109.36 1.19 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.466 ' HB2' HH12 ' A' ' 96' ' ' ARG . 35.1 tt0 -58.84 -40.97 85.8 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.706 -176.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -48.6 80.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.628 -176.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -63.28 -47.85 80.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.859 0.362 . . . . 0.0 110.251 -175.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.414 ' HB2' ' HB2' ' A' ' 45' ' ' TYR . 21.5 t90 -61.1 -52.28 65.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.462 175.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.499 ' HD2' ' HB2' ' A' ' 23' ' ' LEU . 26.3 tptp -52.57 -60.26 3.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.188 -177.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.8 m -60.06 -31.53 70.07 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.98 -173.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.0 t -85.32 -30.71 23.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 0.0 111.533 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.564 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.9 -18.76 26.88 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.328 0.585 . . . . 0.0 110.617 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.405 ' OD2' ' HG3' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -65.23 -8.14 16.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.88 -1.055 . . . . 0.0 111.414 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -116.37 16.34 15.72 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.497 0.665 . . . . 0.0 110.206 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.564 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 37.1 mt -87.04 141.28 33.02 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 121.495 0.664 . . . . 0.0 111.575 -178.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.712 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 68.7 Cg_endo -80.22 -30.13 2.23 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 123.919 3.079 . . . . 0.0 112.956 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.712 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.2 p90 -102.16 -169.28 1.65 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.258 -172.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.553 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 44.9 t -77.79 133.17 31.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.882 -176.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.536 ' SG ' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -140.63 95.48 2.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.431 0.634 . . . . 0.0 110.399 -176.12 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.487 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 18.0 m -113.79 170.27 4.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.158 -174.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.466 HH12 ' HB2' ' A' ' 80' ' ' GLU . 38.0 ttp180 -126.19 138.31 53.64 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.599 0.238 . . . . 0.0 111.039 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -81.1 157.59 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.027 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.406 ' C ' HD22 ' A' ' 99' ' ' ASN . . . -81.56 -23.3 37.27 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -175.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.406 HD22 ' C ' ' A' ' 98' ' ' ALA . 0.8 OUTLIER -122.59 -11.71 8.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.646 0.26 . . . . 0.0 111.642 -178.258 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 71.23 -121.1 8.85 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.606 -0.806 . . . . 0.0 111.853 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.26 -14.93 62.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.984 0.421 . . . . 0.0 110.928 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -95.88 12.25 30.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.566 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.488 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.2 t -65.97 141.59 58.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.78 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.8 m -69.82 -24.03 63.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.202 177.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.404 ' CE1' HG12 ' A' ' 18' ' ' ILE . 63.7 m-85 -59.56 -47.66 84.7 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.533 HG22 HG11 ' A' ' 111' ' ' VAL . 32.5 mt -57.99 -36.67 57.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.281 -176.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.8 m -68.93 -27.22 65.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.283 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.5 -27.15 64.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.753 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -87.17 1.53 52.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.64 179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 48.13 29.03 1.68 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.74 0.816 . . . . 0.0 111.182 -177.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.533 HG11 HG22 ' A' ' 106' ' ' ILE . 11.2 p -43.42 135.47 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.982 -171.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 20.0 p -88.96 -28.98 19.88 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.62 177.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -162.38 146.99 12.23 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.756 0.313 . . . . 0.0 111.434 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 27.7 mt -131.84 160.65 66.71 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 174.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.492 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 63.1 Cg_endo -71.7 156.09 97.46 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.853 -1.311 . . . . 0.0 113.017 0.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.48 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 5.9 m -146.16 173.74 11.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.263 -177.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.406 HG11 HD21 ' A' ' 136' ' ' LEU . 2.4 p -129.59 161.33 39.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.034 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.606 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.5 m-85 -137.6 157.78 45.78 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 174.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.891 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 6.8 tp -110.96 139.35 46.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -175.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.0 t -135.62 121.02 29.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.552 0.215 . . . . 0.0 110.964 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -76.39 164.15 26.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 34.1 mtt180 -52.3 -18.59 1.64 Allowed 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.155 0.91 . . . . 0.0 113.319 -169.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -84.74 6.25 25.08 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -175.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.505 ' HB2' ' HB2' ' A' ' 34' ' ' LYS . 1.6 t-20 63.0 52.23 2.64 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.538 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 49.5 mt-10 -127.22 143.57 51.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.422 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.0 tt -68.85 109.81 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.306 0.574 . . . . 0.0 110.176 -179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.891 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 58.1 m -76.82 -53.96 7.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.291 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -162.54 153.83 17.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.156 -177.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.587 ' O ' HG13 ' A' ' 133' ' ' ILE . 91.7 mtt180 -89.28 156.81 18.5 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.328 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.16 -26.14 60.9 Favored Glycine 0 C--O 1.225 -0.463 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -71.64 -11.78 61.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.443 0.639 . . . . 0.0 110.393 177.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -115.67 -37.22 4.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.069 -176.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.77 HG21 ' HG ' ' A' ' 136' ' ' LEU . 42.7 mt -68.65 145.97 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 48.3 mttp -128.94 -43.02 1.36 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -130.78 111.92 12.58 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.552 173.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.77 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.8 mp -77.67 -30.48 52.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.963 -178.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -48.38 -57.83 5.49 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.609 0.568 . . . . 0.0 110.529 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.625 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 37.5 mm-40 -58.84 -43.02 90.65 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.935 175.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.506 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -60.76 -43.14 98.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.341 -175.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.75 HD12 HD12 ' A' ' 60' ' ' LEU . 40.7 mt -57.89 -44.43 86.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.717 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' A' ' 138' ' ' GLU . 22.7 mttt -51.1 -55.42 17.78 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.447 0.642 . . . . 0.0 111.234 176.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.625 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 2.6 ptpt -74.2 -18.07 60.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.228 -0.897 . . . . 0.0 112.353 -173.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 51.7 mt -83.71 -40.06 19.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.64 0.257 . . . . 0.0 111.245 173.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 71.8 mt -56.82 -49.84 74.19 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.8 175.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -72.28 -55.28 7.42 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.612 176.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 84.33 127.43 1.53 Allowed Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.676 179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 70.5 t60 -75.88 67.53 2.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.294 0.569 . . . . 0.0 109.685 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -112.98 -54.41 2.63 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.359 -178.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -176.1 171.91 2.46 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 123.483 0.489 . . . . 0.0 110.031 177.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 74.5 t60 -68.16 99.86 0.95 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.117 0.484 . . . . 0.0 110.92 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -112.87 -0.61 14.84 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 . . . . . 0 C--O 1.25 1.096 0 CA-C-N 114.108 -1.405 . . . . 0.0 107.99 -174.617 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.405 ' N ' ' HA ' ' A' ' 32' ' ' ASP . 25.2 ttt . . . . . 0 N--CA 1.483 1.216 0 CA-C-O 120.557 0.218 . . . . 0.0 110.49 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.424 ' O ' ' HB ' ' A' ' 31' ' ' THR . 16.6 m -129.95 110.35 11.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.671 -0.241 . . . . 0.0 110.663 -177.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' A' ' 3' ' ' LEU . 2.1 tm? -85.5 105.25 15.97 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 177.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -85.85 142.81 28.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.867 -174.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.6 mt -128.38 95.73 32.46 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.31 179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.561 ' HG2' ' HA ' ' A' ' 13' ' ' ALA . 6.1 Cg_exo -75.77 -164.84 0.26 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 123.236 2.624 . . . . 0.0 112.478 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.491 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 44.4 mt-10 -99.06 -169.9 1.84 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.382 0.61 . . . . 0.0 111.795 -175.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -90.76 10.18 27.06 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.239 174.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.491 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -91.82 -170.48 2.58 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.672 -176.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.0 mm -54.43 134.22 17.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.567 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.823 ' HB3' ' HA ' ' A' ' 14' ' ' SER . 90.5 mttt 63.06 71.91 0.5 Allowed 'General case' 0 N--CA 1.438 -1.063 0 O-C-N 123.79 0.681 . . . . 0.0 110.474 -171.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.516 ' H ' ' CD ' ' A' ' 12' ' ' GLU . 1.2 mp0 -65.2 -13.13 57.51 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.202 -176.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.561 ' HA ' ' HG2' ' A' ' 6' ' ' PRO . . . -129.07 -2.16 5.15 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.435 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.823 ' HA ' ' HB3' ' A' ' 11' ' ' LYS . 42.0 m 68.14 -53.15 0.53 Allowed 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.704 0.801 . . . . 0.0 112.057 -177.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.644 HG21 ' O ' ' A' ' 124' ' ' ASN . 7.7 pt -132.32 -164.76 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 178.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.465 ' O ' HD12 ' A' ' 30' ' ' LEU . 89.0 mt -108.55 113.86 45.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 173.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -98.5 108.55 21.27 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 mt -94.4 121.43 45.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.714 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.573 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 32.3 mt-30 -119.04 100.77 7.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.49 -177.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.1 mt -135.3 154.46 51.53 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 177.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.609 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 93.0 mttt -79.16 141.62 37.07 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.159 0.504 . . . . 0.0 110.894 -176.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.63 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 4.0 p-10 -88.45 -169.02 2.39 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.902 -177.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.443 HD13 ' HB3' ' A' ' 87' ' ' ALA . 49.3 tp -52.99 -37.83 61.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.702 177.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.432 ' HB2' HD22 ' A' ' 26' ' ' ASN . 38.7 mttp -71.2 -27.79 63.75 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.863 -177.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.26 18.52 14.61 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.504 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.432 HD22 ' HB2' ' A' ' 24' ' ' LYS . 50.5 m-80 -108.27 127.9 54.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 178.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.609 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 12.7 m -63.12 110.6 1.89 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.383 0.611 . . . . 0.0 110.856 178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.573 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 21.3 mmm180 -86.15 134.85 33.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.419 -0.809 . . . . 0.0 108.967 175.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.1 p -118.5 155.91 30.0 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 173.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.594 HD22 HG11 ' A' ' 38' ' ' VAL . 71.9 mt -73.29 -23.14 60.26 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.424 ' HB ' ' O ' ' A' ' 2' ' ' SER . 5.9 p -71.82 -0.92 12.36 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.72 175.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.405 ' HA ' ' N ' ' A' ' 1' ' ' MET . 35.5 t70 -98.11 -47.11 5.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.954 0.407 . . . . 0.0 110.882 178.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' A' ' 38' ' ' VAL . 0.6 OUTLIER -91.9 24.72 3.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.71 0.767 . . . . 0.0 109.41 175.334 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.605 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 59.4 tttp -55.92 -42.95 76.85 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 113.983 -1.462 . . . . 0.0 112.524 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -74.16 3.45 38.49 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 115.786 -0.643 . . . . 0.0 113.478 -176.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 6.6 mppt? -125.47 168.81 13.1 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.761 HG21 HD23 ' A' ' 144' ' ' LEU . 45.5 t -73.19 124.91 31.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 177.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' A' ' 33' ' ' LEU . 46.7 t -109.01 124.39 65.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.387 0.613 . . . . 0.0 111.462 -169.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.457 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.2 tp -97.35 133.61 41.72 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 171.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.592 HG13 ' HB2' ' A' ' 118' ' ' PHE . 1.1 pt -118.1 106.9 20.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.185 0.517 . . . . 0.0 110.873 175.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.474 ' HB2' ' HA ' ' A' ' 73' ' ' GLN . 13.8 m-20 -98.22 133.28 42.86 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.858 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -117.33 97.32 5.84 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.459 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 11.1 t -143.7 179.27 7.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 -175.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.668 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -126.02 124.29 65.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 120.725 0.298 . . . . 0.0 110.325 -178.879 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.71 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 28.8 m-85 -74.98 79.43 2.18 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.235 0.54 . . . . 0.0 110.006 177.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 41.3 t30 172.95 -32.33 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.366 -1.288 . . . . 0.0 108.661 174.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.668 ' HB2' HG13 ' A' ' 44' ' ' VAL . 37.4 t-20 -65.1 133.89 52.6 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.852 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.91 -30.8 69.28 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.529 -179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 90.0 mtp -67.94 -22.54 65.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.347 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.9 t -71.14 -23.33 62.05 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.288 -178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.81 18.27 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.848 0.356 . . . . 0.0 110.718 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.04 -39.31 93.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.69 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.482 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.3 t60 -62.85 -45.12 94.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.991 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.659 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.3 m-20 -74.7 -22.17 58.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.782 -176.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.471 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -68.58 -43.57 76.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.36 -38.88 81.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.737 174.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 54' ' ' ASN . 86.7 mt -62.51 -42.29 99.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.001 177.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.471 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.4 tpm_? -54.84 -36.03 64.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.777 176.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -79.97 -50.29 10.63 Favored 'General case' 0 CA--C 1.498 -1.045 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 -173.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.854 HD12 HD12 ' A' ' 140' ' ' ILE . 2.7 mm? -55.77 -30.72 61.74 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 113.271 -1.786 . . . . 0.0 111.429 178.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -72.72 -48.38 39.24 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-O 121.231 0.539 . . . . 0.0 109.685 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -63.38 -21.18 66.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.643 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.564 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 33.5 mttm -82.21 -61.32 1.93 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.925 -178.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.498 ' HB3' HD11 ' A' ' 144' ' ' LEU . 83.8 m-85 -113.35 -5.85 13.55 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -164.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.592 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.15 -34.9 75.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 118.248 0.476 . . . . 0.0 111.585 -176.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.9 m -63.17 -22.07 66.62 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.775 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -98.57 18.59 16.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.701 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.04 54.43 1.62 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.344 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.592 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 54.0 t80 -132.29 125.9 32.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.71 0.29 . . . . 0.0 110.274 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.461 ' HB3' HD12 ' A' ' 33' ' ' LEU . 28.9 tt0 -125.36 154.73 41.4 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.583 ' HB ' ' CB ' ' A' ' 92' ' ' TRP . 49.8 mt -118.8 126.32 75.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.06 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.497 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 75.7 t80 -112.78 100.12 8.43 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.275 -0.875 . . . . 0.0 108.859 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.474 ' HA ' ' HB2' ' A' ' 41' ' ' ASP . 6.1 tt0 -102.48 126.32 49.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.348 -175.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 54.9 mt -103.56 129.09 56.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.339 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.71 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 3.8 p -95.85 131.63 41.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.487 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 22.2 mt -116.45 33.67 5.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.24 0.543 . . . . 0.0 109.741 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.5 ' OD2' ' HB2' ' A' ' 75' ' ' SER . 3.5 p30 -85.29 -165.91 1.35 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.752 -175.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -135.5 30.16 2.81 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.779 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -151.36 101.93 2.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.993 0.425 . . . . 0.0 110.632 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -64.98 -31.76 73.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.653 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -46.0 90.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.564 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -71.97 -42.02 67.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.834 0.349 . . . . 0.0 110.6 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 36.9 t90 -60.77 -48.38 82.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.747 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.465 ' HB2' ' HE3' ' A' ' 84' ' ' LYS . 37.2 ttmt -62.18 -42.14 98.99 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.806 -175.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 7.9 p -71.22 -40.15 71.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.831 0.348 . . . . 0.0 111.264 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.53 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 25.3 t -69.9 -45.62 67.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.713 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.443 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -66.95 -26.32 66.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.622 -176.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.404 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 27.7 t70 -61.85 -31.34 71.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.763 0.315 . . . . 0.0 111.071 -178.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -102.64 7.86 39.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.935 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 86' ' ' SER . 40.0 mt -94.74 140.62 22.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.233 0.54 . . . . 0.0 111.339 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.62 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.2 Cg_endo -72.45 -49.3 0.28 Allowed 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 123.875 3.05 . . . . 0.0 113.938 -174.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.62 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.1 p90 -81.88 -172.31 3.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.984 0.421 . . . . 0.0 111.933 -173.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.439 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 90.6 t -85.8 117.52 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.357 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 34.1 m -113.68 108.8 17.61 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.911 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.63 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 23.2 m -114.77 172.1 4.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.934 -179.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -133.04 140.37 47.68 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.085 -177.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -93.03 151.0 20.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 178.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.06 -18.52 42.84 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 25.1 m-80 -115.82 -12.17 11.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.812 0.339 . . . . 0.0 111.033 -175.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.487 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 66.41 -121.29 17.43 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.074 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.62 -6.81 43.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.765 0.316 . . . . 0.0 111.303 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -100.97 15.8 27.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.428 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.442 ' HB3' HG13 ' A' ' 106' ' ' ILE . 32.6 t -63.6 132.68 51.94 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.172 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.5 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 16.5 m -59.38 -28.95 67.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.172 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -60.79 -45.42 94.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.735 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.442 HG13 ' HB3' ' A' ' 103' ' ' SER . 43.2 mt -58.0 -36.2 55.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.113 0.482 . . . . 0.0 110.433 -177.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -72.67 -39.66 66.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.535 177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.7 mt -64.26 -32.12 73.58 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.573 -178.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -69.99 -27.3 64.6 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.947 177.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.46 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER 57.97 61.91 2.22 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 -164.575 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.0 p -69.97 153.37 8.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 114.358 -1.292 . . . . 0.0 110.749 -176.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 47.5 p -93.82 -34.48 13.15 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.931 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.428 HD22 ' N ' ' A' ' 113' ' ' ASN . 0.0 OUTLIER -165.43 174.32 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.907 -178.065 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 115' ' ' PRO . 0.3 OUTLIER -159.59 151.02 16.45 Favored Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -177.475 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.613 ' HA ' HD23 ' A' ' 114' ' ' LEU . 33.6 Cg_endo -63.83 139.97 36.87 Favored 'Cis proline' 0 C--N 1.354 0.858 0 C-N-CA 124.371 -1.096 . . . . 0.0 113.433 1.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.11 177.6 7.33 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.98 -177.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 7.9 p -138.05 159.25 33.09 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.647 ' HE2' ' HD2' ' A' ' 129' ' ' ARG . 86.2 m-85 -138.04 163.27 32.02 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 1.025 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 8.4 tp -110.98 135.03 52.1 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.745 -174.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 49.1 t -131.18 117.53 37.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.32 0.581 . . . . 0.0 110.301 172.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.463 ' HA ' HD13 ' A' ' 143' ' ' LEU . 31.4 t30 -70.84 161.15 31.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.848 178.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 122' ' ' ARG . 17.0 ptt180 -73.88 29.68 0.08 Allowed 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -170.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.541 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 4.4 t-20 -120.37 2.97 10.83 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 169.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.644 ' O ' HG21 ' A' ' 15' ' ' ILE . 0.2 OUTLIER 69.28 62.78 0.29 Allowed 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.709 -167.016 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.541 ' HG3' ' HB3' ' A' ' 123' ' ' ASN . 38.3 mt-10 -122.2 123.81 42.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.019 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.4 tt -62.04 106.8 0.76 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 171.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 1.025 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 47.0 m -83.08 -54.7 4.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.972 -172.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -167.66 172.13 9.58 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.755 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.647 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 19.6 mmt85 -78.62 175.39 10.43 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -80.63 -26.62 53.65 Favored Glycine 0 C--N 1.315 -0.585 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.616 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.459 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 mp0 -75.47 -41.85 54.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.164 0.507 . . . . 0.0 112.021 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.611 HD22 ' N ' ' A' ' 133' ' ' ILE . 0.2 OUTLIER -81.03 -6.58 58.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.704 -176.332 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.645 HG21 ' HG ' ' A' ' 136' ' ' LEU . 63.3 mt -85.61 110.26 19.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.313 0.578 . . . . 0.0 109.975 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -61.01 -25.36 66.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.026 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 137' ' ' ASP . 36.2 t70 -173.05 116.48 0.28 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.645 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.4 mp -75.17 -28.52 60.11 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.924 -0.311 . . . . 0.0 111.043 -176.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.471 ' HB3' ' OD2' ' A' ' 135' ' ' ASP . 9.3 t70 -53.51 -54.93 30.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 173.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -53.22 -48.55 68.07 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.666 172.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.509 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -64.24 -52.12 60.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.373 -172.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.854 HD12 HD12 ' A' ' 60' ' ' LEU . 37.6 mt -61.3 -36.83 75.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.275 0.56 . . . . 0.0 110.295 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 17.2 ttpt -60.11 -40.0 88.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.149 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 139' ' ' ALA . 17.1 ptpt -85.02 -19.73 31.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.244 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.515 HD11 ' HG ' ' A' ' 119' ' ' LEU . 16.0 mt -75.15 -32.83 61.43 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.682 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.761 HD23 HG21 ' A' ' 37' ' ' VAL . 34.0 mt -53.91 -35.47 61.68 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.518 178.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.692 ' HB2' ' HA ' ' A' ' 151' ' ' HIS . 9.2 pt-20 -84.11 -39.23 19.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.962 0.41 . . . . 0.0 110.149 176.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 114.81 -122.27 5.6 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.871 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 35.4 m80 -90.64 29.52 1.3 Allowed 'General case' 0 C--N 1.326 -0.413 0 O-C-N 122.791 -0.24 . . . . 0.0 110.838 -177.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . 0.672 ' HA ' ' OE1' ' A' ' 145' ' ' GLU . 0.5 OUTLIER 55.66 54.16 8.67 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.489 179.366 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 30.6 m-70 -141.34 8.6 2.02 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.318 174.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 33.4 t60 -174.7 95.84 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.046 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.692 ' HA ' ' HB2' ' A' ' 145' ' ' GLU . 32.3 p80 -70.09 162.7 27.74 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 175.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 45.5 t60 . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.453 -0.784 . . . . 0.0 109.024 171.48 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 120.689 0.28 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 m -80.4 146.88 31.25 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.227 -177.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.569 HD12 ' N ' ' A' ' 4' ' ' GLU . 1.5 pp -80.0 -22.24 42.71 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.391 0.615 . . . . 0.0 110.623 177.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.569 ' N ' HD12 ' A' ' 3' ' ' LEU . 0.7 OUTLIER -157.55 -175.05 5.17 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 106.082 -1.821 . . . . 0.0 106.082 175.369 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.503 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 45.6 mm 62.81 88.08 0.12 Allowed Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -171.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -58.18 164.28 8.76 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.296 2.664 . . . . 0.0 114.526 -166.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.684 ' HA ' ' HG3' ' A' ' 12' ' ' GLU . 7.5 pt-20 -151.09 104.62 3.15 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.732 -1.576 . . . . 0.0 108.439 -177.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -157.1 97.99 1.7 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.823 0.344 . . . . 0.0 111.804 -170.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm 68.63 -75.5 0.07 Allowed 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.145 175.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.8 pt -148.94 30.05 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 CA-C-N 114.557 -1.202 . . . . 0.0 110.563 -176.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -134.26 41.18 2.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.841 0.829 . . . . 0.0 110.34 -176.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.684 ' HG3' ' HA ' ' A' ' 7' ' ' GLU . 4.8 mp0 -74.88 134.99 41.54 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.182 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.474 ' C ' ' H ' ' A' ' 15' ' ' ILE . . . 68.23 -71.35 0.11 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.457 -173.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.1 t 70.23 -15.93 0.32 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.364 0.666 . . . . 0.0 111.662 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.474 ' H ' ' C ' ' A' ' 13' ' ' ALA . 5.3 tp -163.98 145.23 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.454 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.1 mp -98.9 104.56 16.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.11 110.9 2.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.288 0.566 . . . . 0.0 110.093 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.465 HG21 ' CD1' ' A' ' 74' ' ' ILE . 25.1 mm -90.4 108.6 19.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.259 -178.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.626 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 19.4 mt-30 -105.31 99.8 9.4 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.192 0.52 . . . . 0.0 110.795 175.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 59.2 mt -138.35 159.0 43.19 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.647 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 46.0 mtmt -89.69 138.18 31.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.737 0.779 . . . . 0.0 111.395 -177.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.636 ' OD1' ' HG ' ' A' ' 23' ' ' LEU . 9.9 t70 -71.09 169.04 15.85 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.819 -1.537 . . . . 0.0 109.821 176.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.848 HD13 ' HA ' ' A' ' 88' ' ' ASP . 2.5 pp -51.82 -34.68 41.34 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.695 0.759 . . . . 0.0 111.212 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -69.34 -6.91 32.76 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.115 177.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.53 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 89.74 7.91 68.18 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.308 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -101.69 118.29 36.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.553 0.216 . . . . 0.0 111.487 -175.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.647 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 24.3 m -58.28 124.01 18.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.223 0.535 . . . . 0.0 110.839 176.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.626 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.3 mmm180 -107.03 142.98 35.8 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.563 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 57.5 p -120.17 162.34 19.51 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.681 ' HB3' HD21 ' A' ' 124' ' ' ASN . 49.9 mt -80.1 -29.65 39.07 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.3 p -59.33 -22.89 61.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.701 173.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -85.5 -52.56 5.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.153 176.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.58 -13.98 11.52 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.221 -178.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.613 ' NZ ' ' HB3' ' A' ' 34' ' ' LYS . 3.6 ttpm? -53.48 -14.98 0.91 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.224 1.01 . . . . 0.0 112.475 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.53 ' C ' ' HD2' ' A' ' 36' ' ' LYS . . . -64.1 -16.37 59.8 Favored Glycine 0 CA--C 1.521 0.422 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.651 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.53 ' HD2' ' C ' ' A' ' 35' ' ' GLY . 2.9 mptp? -136.14 -178.9 5.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.914 0.388 . . . . 0.0 110.397 176.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.719 HG21 HD23 ' A' ' 144' ' ' LEU . 56.3 t -78.58 123.29 35.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 172.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.1 t -103.32 122.27 55.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.308 0.575 . . . . 0.0 112.204 -163.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.785 HD11 HD21 ' A' ' 136' ' ' LEU . 13.0 tp -92.06 122.13 34.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.739 171.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.534 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 14.0 mm -98.98 106.03 18.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.714 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 25.6 t70 -108.4 131.07 55.14 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.869 -178.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.511 ' HD2' HD11 ' A' ' 76' ' ' LEU . 32.7 m-85 -119.63 97.77 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.106 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.583 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.2 t -137.39 164.87 27.58 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.996 0.427 . . . . 0.0 111.233 -175.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.597 HG23 ' HB2' ' A' ' 47' ' ' ASN . 3.4 m -102.49 116.75 46.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.051 0.453 . . . . 0.0 110.437 177.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.416 ' HB3' ' HA ' ' A' ' 83' ' ' TRP . 7.4 m-85 -74.89 84.13 2.2 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.699 0.761 . . . . 0.0 109.057 175.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 177.69 -37.81 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.149 -165.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.597 ' HB2' HG23 ' A' ' 44' ' ' VAL . 10.1 t-20 -89.76 146.56 24.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.983 -1.462 . . . . 0.0 111.383 -169.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.31 -30.77 71.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.724 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.3 mmm -64.27 -27.19 68.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.793 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.9 m -69.33 -28.25 66.07 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.164 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.72 -55.7 15.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.866 0.365 . . . . 0.0 110.67 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.01 -34.03 77.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.623 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.495 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 67.8 t60 -66.13 -38.25 87.7 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.454 178.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.447 ' HA ' HD12 ' A' ' 57' ' ' LEU . 23.4 t-20 -66.95 -39.45 87.29 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.455 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -57.34 -50.23 73.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.323 0.582 . . . . 0.0 110.501 177.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.03 83.8 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.005 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.4 mt -62.97 -42.38 99.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.461 0.648 . . . . 0.0 109.943 175.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -61.68 -28.83 69.68 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.023 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -72.28 -53.25 13.02 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.708 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -56.56 -32.1 64.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 112.345 -2.207 . . . . 0.0 111.072 176.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -73.1 -47.66 42.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.119 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -61.93 -22.46 65.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.263 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -79.7 -55.83 4.72 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.666 -179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.611 ' HB3' HD11 ' A' ' 144' ' ' LEU . 93.6 m-85 -118.09 -11.4 10.18 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -165.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.528 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -56.33 -42.87 78.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -174.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.3 p -54.2 -43.48 70.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.414 -176.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -69.69 -33.21 72.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.321 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 151.81 47.74 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.303 -0.951 . . . . 0.0 112.582 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.644 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 66.9 t80 -127.92 138.77 52.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.359 -0.238 . . . . 0.0 110.359 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.36 155.56 49.25 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.454 ' O ' ' HB2' ' A' ' 92' ' ' TRP . 46.3 mt -116.84 114.97 47.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.446 0.641 . . . . 0.0 110.503 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.482 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 87.7 t80 -100.48 101.3 12.21 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.606 178.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.714 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 10.7 mt-30 -94.86 143.18 26.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.031 -177.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.465 ' CD1' HG21 ' A' ' 18' ' ' ILE . 57.3 mt -127.21 124.88 65.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.715 176.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.627 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 10.7 p -92.49 129.91 38.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.947 0.403 . . . . 0.0 111.116 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.511 HD11 ' HD2' ' A' ' 42' ' ' PHE . 25.1 mt -112.45 10.5 19.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.88 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.627 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 3.9 p-10 -69.22 -49.99 51.32 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.322 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 125.94 -34.54 3.24 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.632 176.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -87.04 136.36 32.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.934 0.874 . . . . 0.0 111.367 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 44.1 tt0 -78.7 -29.0 45.23 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.7 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -79.59 -50.6 10.45 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.286 -167.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -65.44 -39.31 91.9 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 177.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.498 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 16.0 t90 -61.99 -47.93 82.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.792 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.698 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 46.2 tttm -68.34 -49.72 58.33 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.968 -176.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 22.6 p -58.93 -30.31 67.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.202 0.525 . . . . 0.0 111.423 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.1 m -82.84 -46.22 13.32 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.684 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.512 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -88.24 -18.8 27.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -171.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.848 ' HA ' HD13 ' A' ' 23' ' ' LEU . 3.6 t70 -55.36 -33.56 63.52 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.93 0.492 . . . . 0.0 111.981 -170.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -104.26 11.72 34.54 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.145 -176.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.512 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 23.3 mt -81.83 157.7 68.86 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 121.121 0.486 . . . . 0.0 111.712 -176.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.624 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 72.1 Cg_endo -69.8 -44.41 2.07 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.744 2.963 . . . . 0.0 114.208 -176.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.624 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -100.75 -170.69 1.89 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 112.005 -171.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.559 HG11 ' HG3' ' A' ' 28' ' ' ARG . 90.3 t -83.79 135.78 24.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.775 -176.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 84.0 m -136.17 108.81 7.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.07 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.428 HG12 ' CA ' ' A' ' 22' ' ' ASP . 14.6 m -113.89 159.8 13.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.009 -177.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 80' ' ' GLU . 12.2 ttp180 -117.73 134.42 54.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.927 -0.309 . . . . 0.0 111.379 -177.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -92.69 143.56 26.18 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.35 -14.09 55.84 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -99.95 -13.31 19.17 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.744 -172.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.41 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . 64.62 -98.45 0.28 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.747 178.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -105.92 1.49 26.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.956 0.408 . . . . 0.0 110.891 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -104.56 9.47 35.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.119 0.485 . . . . 0.0 110.193 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.534 ' HB2' HG13 ' A' ' 106' ' ' ILE . 4.2 m -65.27 122.21 16.59 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.554 -178.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.543 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 10.3 m -55.17 -27.1 43.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.867 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -55.59 -47.24 76.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.613 177.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.537 ' CG2' HG11 ' A' ' 111' ' ' VAL . 53.1 mt -57.07 -34.77 45.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.765 -176.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.9 m -77.17 -37.27 54.11 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 177.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 104' ' ' SER . 96.7 mt -63.58 -37.65 88.11 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.599 -178.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -71.53 -24.41 61.94 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.871 -0.331 . . . . 0.0 111.412 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 59.53 79.88 0.21 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 122.1 0.953 . . . . 0.0 108.758 -165.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.537 HG11 ' CG2' ' A' ' 106' ' ' ILE . 9.9 p -92.71 145.5 7.55 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.077 -174.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 15.1 m -90.81 -40.6 11.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.294 176.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -170.11 127.52 0.85 Allowed 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -174.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.469 HD13 ' OG ' ' A' ' 116' ' ' SER . 3.7 mm? -88.83 147.32 38.79 Favored Pre-proline 0 N--CA 1.465 0.28 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 174.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.97 143.02 74.8 Favored 'Cis proline' 0 C--N 1.349 0.573 0 C-N-CA 123.86 -1.308 . . . . 0.0 112.919 0.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.469 ' OG ' HD13 ' A' ' 114' ' ' LEU . 13.3 m -121.04 169.99 9.96 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.464 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.8 p -142.25 156.71 19.42 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 174.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.534 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 82.7 m-85 -140.23 160.16 40.57 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.921 HD13 HD11 ' A' ' 136' ' ' LEU . 13.9 tp -111.0 134.93 52.21 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -174.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.49 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 25.6 t -135.51 120.44 28.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.775 0.321 . . . . 0.0 110.554 177.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.641 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.1 p30 -77.74 167.56 21.36 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.86 4.68 0.78 Allowed 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -168.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -95.65 5.3 51.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 172.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.681 HD21 ' HB3' ' A' ' 30' ' ' LEU . 1.7 t-20 64.42 48.05 2.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.277 -172.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.641 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 42.4 mt-10 -119.12 136.85 53.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.615 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.1 mt -64.86 118.05 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.324 0.583 . . . . 0.0 110.801 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.619 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 18.4 m -87.31 -53.45 4.83 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.877 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.09 169.14 14.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.172 -179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.47 ' O ' HG13 ' A' ' 133' ' ' ILE . 93.4 mtt180 -91.7 168.33 11.55 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.885 177.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -65.16 -36.55 93.03 Favored Glycine 0 CA--C 1.509 -0.316 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.463 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.6 pm0 -75.93 -0.14 20.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.086 0.469 . . . . 0.0 111.125 177.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -110.07 -19.47 13.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.167 0.508 . . . . 0.0 110.05 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.535 HD11 ' HB2' ' A' ' 119' ' ' LEU . 97.2 mt -82.9 108.3 15.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.73 -177.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.78 ' HD2' ' H ' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -82.99 -26.34 31.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.955 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -161.36 110.43 1.58 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.921 HD11 HD13 ' A' ' 119' ' ' LEU . 2.8 tp -76.78 -33.17 58.05 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.754 -175.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.456 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.1 t70 -51.54 -52.83 43.81 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.48 177.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.543 ' O ' ' HE3' ' A' ' 142' ' ' LYS . 28.7 mm-40 -56.57 -52.22 65.64 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.64 174.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.468 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -61.97 -50.6 71.45 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.183 -172.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.708 HD12 HD12 ' A' ' 60' ' ' LEU . 52.2 mt -59.55 -40.54 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.213 0.53 . . . . 0.0 110.249 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.428 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 29.4 ttpt -56.78 -47.59 79.84 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.016 178.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.543 ' HE3' ' O ' ' A' ' 138' ' ' GLU . 11.5 ptpt -81.54 -18.88 43.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.76 -176.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 40.2 mt -71.91 -39.59 69.42 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.7 0.286 . . . . 0.0 110.401 173.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.719 HD23 HG21 ' A' ' 37' ' ' VAL . 66.6 mt -58.37 -39.74 80.39 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.504 0.669 . . . . 0.0 109.938 176.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.607 ' HA ' ' CE1' ' A' ' 152' ' ' HIS . 39.5 mt-10 -66.87 -64.32 0.88 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.055 175.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 98.77 -48.05 1.36 Allowed Glycine 0 N--CA 1.442 -0.93 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.772 -177.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . 0.559 ' O ' ' HD2' ' A' ' 150' ' ' HIS . 94.1 m-70 60.87 -89.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 123.435 0.694 . . . . 0.0 111.411 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 62.18 -78.45 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.95 0.5 . . . . 0.0 111.665 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -153.63 24.7 0.52 Allowed 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.559 ' HD2' ' O ' ' A' ' 147' ' ' HIS . 0.3 OUTLIER -142.2 169.14 18.14 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.729 178.631 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.526 ' O ' ' HB2' ' A' ' 152' ' ' HIS . 48.2 t60 -75.42 74.38 2.49 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.835 0.35 . . . . 0.0 110.725 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . 0.607 ' CE1' ' HA ' ' A' ' 145' ' ' GLU . 66.0 t-80 . . . . . 0 C--O 1.249 1.033 0 C-N-CA 124.202 1.001 . . . . 0.0 108.359 174.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 mmt . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.9 m -65.38 -45.48 83.87 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -97.38 93.34 6.43 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 168.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -78.34 137.24 37.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.816 -174.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 68.6 mt -107.52 112.68 62.31 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.403 -178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -85.38 -179.76 3.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.681 2.254 . . . . 0.0 112.004 177.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 48.96 -171.75 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.478 1.111 . . . . 0.0 113.409 176.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -159.38 14.57 0.15 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.113 -178.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.722 ' HG2' ' H ' ' A' ' 10' ' ' ILE . 3.2 ttmp? -137.84 -146.26 0.21 Allowed 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.779 -167.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.722 ' H ' ' HG2' ' A' ' 9' ' ' LYS . 37.4 pt -77.96 170.83 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 167.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.888 ' HE2' HD11 ' A' ' 16' ' ' ILE . 6.0 tmtm? -51.43 109.6 0.36 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.171 0.51 . . . . 0.0 111.612 -177.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -130.28 -28.07 2.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.633 0.73 . . . . 0.0 110.081 173.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -126.27 -31.84 2.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.724 -1.126 . . . . 0.0 111.252 -177.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 63.3 m -47.41 119.09 2.49 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.813 0.816 . . . . 0.0 111.699 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.4 tp -70.22 138.47 21.93 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 113.811 -1.541 . . . . 0.0 110.718 176.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.888 HD11 ' HE2' ' A' ' 11' ' ' LYS . 4.2 mp -101.69 126.23 55.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 177.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -80.03 108.02 13.28 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.491 HD11 ' OH ' ' A' ' 109' ' ' TYR . 11.1 mt -96.07 125.3 48.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.729 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.612 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 28.9 mt-30 -118.73 99.96 7.11 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.985 0.421 . . . . 0.0 110.365 -178.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.7 mt -133.63 156.46 47.84 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 95.4 mttt -87.64 139.63 30.34 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.053 0.454 . . . . 0.0 111.308 -174.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.584 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 7.8 p30 -87.82 -167.22 1.81 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.892 -176.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.578 HD13 ' HB3' ' A' ' 87' ' ' ALA . 55.3 tp -50.02 -36.15 27.63 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.272 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.618 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 8.9 mtmp? -84.87 -5.53 59.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.497 -176.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.88 17.48 63.27 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -176.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.478 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.9 OUTLIER -97.08 117.26 30.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.209 -0.496 . . . . 0.0 110.275 -177.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.589 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 54.7 m -61.74 118.94 7.8 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.153 0.501 . . . . 0.0 111.269 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.612 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 15.9 mmm180 -101.38 139.17 37.42 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.498 176.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 36.8 p -118.06 161.89 19.09 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 172.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 16' ' ' ILE . 58.0 mt -79.88 -21.29 44.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.642 0.734 . . . . 0.0 109.863 179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.35 -8.21 52.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.625 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -89.94 -60.51 1.91 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.994 0.426 . . . . 0.0 110.512 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.41 ' CD2' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -77.96 9.18 3.81 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 121.782 0.801 . . . . 0.0 111.066 -177.265 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.497 ' NZ ' ' HB3' ' A' ' 124' ' ' ASN . 24.1 ttmm -54.75 141.45 32.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.477 171.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 117.64 -25.53 8.5 Favored Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 -173.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.499 ' NZ ' ' HB2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -120.96 170.62 9.33 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-N 115.344 -0.428 . . . . 0.0 110.287 173.346 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.675 HG13 ' HG2' ' A' ' 122' ' ' ARG . 1.6 m -79.95 134.71 26.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.481 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 41.3 t -117.02 130.98 71.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-O 121.184 0.516 . . . . 0.0 111.155 -170.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.54 ' HB3' HG23 ' A' ' 71' ' ' ILE . 11.8 tp -94.96 107.52 19.56 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.649 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.687 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.8 mm -85.6 105.49 14.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 179.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.438 ' CG ' ' HE2' ' A' ' 53' ' ' HIS . 1.8 t70 -107.18 131.6 53.97 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.287 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -116.03 97.32 6.01 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.734 ' O ' ' HA ' ' A' ' 75' ' ' SER . 22.7 m -144.63 147.32 32.95 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.182 0.515 . . . . 0.0 111.161 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.556 HG13 ' HB2' ' A' ' 47' ' ' ASN . 1.6 p -95.46 123.01 47.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 122.236 -0.29 . . . . 0.0 110.946 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.691 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 30.5 m-85 -82.69 79.07 9.2 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.01 0.91 . . . . 0.0 109.659 175.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.424 ' HB3' HG22 ' A' ' 44' ' ' VAL . 7.3 t-20 -178.13 -35.19 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 113.569 -1.65 . . . . 0.0 109.078 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.556 ' HB2' HG13 ' A' ' 44' ' ' VAL . 30.0 t-20 -71.85 142.86 49.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.558 -178.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.07 -30.12 69.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.822 -175.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 21.8 ptp -71.45 -17.06 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.0 0.429 . . . . 0.0 111.088 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.2 m -71.17 -30.58 66.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.517 -177.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.61 -47.31 86.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.878 0.371 . . . . 0.0 111.137 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.08 -28.89 63.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.133 0.492 . . . . 0.0 110.646 178.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.483 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.5 t60 -68.12 -40.89 82.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.625 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.539 ' HA ' HD12 ' A' ' 57' ' ' LEU . 92.5 m-20 -63.65 -34.01 76.91 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.792 0.33 . . . . 0.0 111.05 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -60.11 -53.75 54.09 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.415 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.54 -35.59 76.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.06 -178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.539 HD12 ' HA ' ' A' ' 54' ' ' ASN . 86.8 mt -64.17 -41.55 97.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.515 0.674 . . . . 0.0 109.69 176.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 58' ' ' ARG . 28.5 tpt85 -64.56 -27.34 68.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.094 -178.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.474 ' OE2' ' HE3' ' A' ' 63' ' ' LYS . 3.7 tm-20 -75.54 -56.16 4.97 Favored 'General case' 0 CA--C 1.489 -1.385 0 CA-C-O 123.003 1.382 . . . . 0.0 107.801 -174.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.546 HD12 HD12 ' A' ' 140' ' ' ILE . 3.0 mm? -55.02 -29.33 57.15 Favored 'General case' 0 N--CA 1.424 -1.748 0 CA-C-N 111.819 -2.446 . . . . 0.0 111.067 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -66.86 -49.17 66.52 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.24 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.34 -26.38 66.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.713 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.474 ' HE3' ' OE2' ' A' ' 59' ' ' GLU . 74.2 mttt -77.02 -61.48 1.97 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.685 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -109.54 -11.84 14.75 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -164.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.587 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.53 -37.9 82.69 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.189 0.45 . . . . 0.0 111.494 -177.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.4 m -65.11 -13.87 59.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.839 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -101.39 6.64 42.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.087 0.47 . . . . 0.0 110.955 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.51 54.24 0.89 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.175 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.594 ' HD1' HG23 ' A' ' 37' ' ' VAL . 37.2 t80 -130.57 131.66 45.13 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 178.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -130.69 156.15 45.4 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.601 HD12 ' CE3' ' A' ' 92' ' ' TRP . 43.6 mt -122.34 129.13 75.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-O 120.995 0.426 . . . . 0.0 110.152 -175.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.484 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 89.8 t80 -113.27 100.4 8.54 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.237 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.79 140.99 29.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.819 -177.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.46 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 59.9 mt -127.16 107.8 17.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.606 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.734 ' HA ' ' O ' ' A' ' 43' ' ' THR . 0.0 OUTLIER -77.77 129.44 35.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.998 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.462 ' H ' ' HA ' ' A' ' 44' ' ' VAL . 48.2 mt -110.34 38.75 2.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.224 0.535 . . . . 0.0 109.897 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.553 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.1 p30 -100.72 -178.77 3.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.449 -175.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 -25.64 4.8 Favored Glycine 0 N--CA 1.444 -0.822 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.481 173.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.607 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 30.4 t70 -103.14 97.47 7.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.997 0.427 . . . . 0.0 110.689 -177.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.662 ' HB3' ' CZ ' ' A' ' 96' ' ' ARG . 10.0 pt-20 -74.79 -13.99 60.65 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.622 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . 0.607 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.2 OUTLIER -52.07 -50.59 61.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.403 173.367 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -70.81 -39.68 72.94 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.165 0.507 . . . . 0.0 110.553 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.616 ' HE3' ' HB2' ' A' ' 80' ' ' GLU . 31.4 t90 -60.27 -46.58 89.32 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.077 176.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -64.43 -43.73 93.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.281 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.7 p -69.45 -39.06 77.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.5 t -72.87 -37.41 67.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.599 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.611 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -70.17 -23.09 62.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.091 -179.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -61.03 -27.08 68.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.708 0.766 . . . . 0.0 110.329 174.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -102.46 12.52 36.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.995 -179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.499 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 24.8 mt -97.98 147.35 32.95 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 121.408 0.623 . . . . 0.0 112.215 -177.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.765 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 14.8 Cg_endo -100.21 3.33 0.8 Allowed 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 124.495 3.463 . . . . 0.0 114.168 -176.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.765 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 2.4 p90 -136.72 -170.09 2.61 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.219 -0.301 . . . . 0.0 111.047 -174.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.486 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 78.7 t -80.89 127.02 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.945 -176.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.611 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 1.6 p -129.63 103.38 6.82 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.209 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.584 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 6.4 m -114.73 156.24 15.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.662 ' CZ ' ' HB3' ' A' ' 80' ' ' GLU . 12.6 ttp180 -120.91 139.06 53.75 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.347 -178.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -89.24 148.54 23.54 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.59 -16.4 51.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 0.0 111.697 -176.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -107.34 -12.15 15.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.17 -174.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.43 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 62.31 -120.69 22.86 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.014 -177.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.48 -5.73 46.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.356 . . . . 0.0 111.476 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -99.6 12.87 35.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.525 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.419 ' HB3' HG13 ' A' ' 106' ' ' ILE . 42.9 t -64.9 133.53 52.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.798 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.457 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.2 m -63.31 -25.1 68.15 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.796 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -60.63 -44.15 96.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.353 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.419 HG13 ' HB3' ' A' ' 103' ' ' SER . 65.3 mt -56.73 -41.3 74.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.989 -179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.5 m -66.12 -27.81 68.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.965 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -73.9 -18.27 60.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.04 -179.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.679 ' HB2' HG23 ' A' ' 111' ' ' VAL . 87.8 m-85 -98.27 0.73 46.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.45 176.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 75.42 -5.28 2.2 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 123.972 0.795 . . . . 0.0 110.501 -177.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.679 HG23 ' HB2' ' A' ' 109' ' ' TYR . 92.3 t -58.34 129.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.415 -171.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.473 ' C ' HD22 ' A' ' 113' ' ' ASN . 20.1 p -130.79 16.02 5.28 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.973 176.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.473 HD22 ' C ' ' A' ' 112' ' ' THR . 1.0 OUTLIER -113.38 -100.89 0.42 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.277 -176.307 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.509 ' HA ' ' C ' ' A' ' 115' ' ' PRO . 46.8 mt 67.93 154.68 0.14 Allowed Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 123.589 0.756 . . . . 0.0 112.436 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.509 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 17.3 Cg_exo -67.61 152.59 85.96 Favored 'Cis proline' 0 C--N 1.354 0.847 0 C-N-CA 123.442 -1.483 . . . . 0.0 111.934 0.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.444 ' HB2' ' CD2' ' A' ' 114' ' ' LEU . 68.7 m -151.21 175.84 11.78 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.034 0.445 . . . . 0.0 111.149 -175.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.454 HG11 HD21 ' A' ' 136' ' ' LEU . 4.4 p -132.66 161.11 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.095 179.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.687 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.2 m-85 -137.42 162.02 34.76 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.921 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 11.9 tp -109.61 135.84 49.93 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.725 -176.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.541 ' CG1' ' HA ' ' A' ' 124' ' ' ASN . 4.0 t -129.84 125.63 61.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.227 0.537 . . . . 0.0 110.654 174.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.546 ' HA ' HG12 ' A' ' 37' ' ' VAL . 28.7 t30 -80.77 167.97 19.34 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.402 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.675 ' HG2' HG13 ' A' ' 37' ' ' VAL . 16.4 mtp180 -56.48 -25.15 50.23 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -165.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.711 ' HB2' ' CD ' ' A' ' 125' ' ' GLU . 90.4 m-20 -90.01 13.16 15.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -177.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.541 ' HA ' ' CG1' ' A' ' 120' ' ' VAL . 2.8 t-20 60.48 57.55 2.77 Favored 'General case' 0 N--CA 1.439 -0.977 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.407 -172.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.711 ' CD ' ' HB2' ' A' ' 123' ' ' ASN . 2.2 mp0 -109.33 134.91 51.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.178 175.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.42 107.08 2.31 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.921 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -78.78 -50.78 10.75 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.36 -173.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.09 167.31 10.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.5 -178.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.602 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.3 OUTLIER -94.58 154.58 17.3 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.547 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -51.5 -41.33 48.8 Favored Glycine 0 C--N 1.33 0.231 0 O-C-N 123.434 0.458 . . . . 0.0 113.871 -175.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.463 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.6 OUTLIER -71.36 -18.09 62.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.897 0.38 . . . . 0.0 110.655 -178.016 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.508 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.8 OUTLIER -101.43 -15.14 17.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.719 -176.667 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.851 HG21 ' HG ' ' A' ' 136' ' ' LEU . 90.0 mt -77.08 99.84 2.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.163 0.506 . . . . 0.0 110.387 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.5 ptmt -74.31 87.77 2.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.202 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.415 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 33.8 t70 69.54 116.3 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.376 -176.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.851 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.1 mp -76.13 -33.57 59.42 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.123 -177.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.519 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.3 t70 -54.15 -59.72 4.28 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.588 ' O ' ' HG2' ' A' ' 142' ' ' LYS . 0.7 OUTLIER -51.89 -46.43 64.52 Favored 'General case' 0 N--CA 1.441 -0.917 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.404 173.268 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.617 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.48 -51.71 68.7 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.033 0.382 . . . . 0.0 112.033 -174.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 136' ' ' LEU . 47.7 mt -57.64 -43.43 83.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.155 0.502 . . . . 0.0 110.081 177.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.484 ' HG2' ' OE1' ' A' ' 145' ' ' GLU . 26.4 ttpp -59.66 -50.83 72.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.951 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.617 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 24.9 pttt -73.35 -17.13 61.32 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 42.9 mt -70.62 -40.72 72.99 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 169.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 87.8 mt -67.93 -44.98 75.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.076 175.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.484 ' OE1' ' HG2' ' A' ' 141' ' ' LYS . 47.5 mt-10 -73.85 -2.99 26.05 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.723 177.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -71.51 -59.54 4.82 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 44.5 m80 60.33 -167.59 0.18 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.764 0.316 . . . . 0.0 110.479 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 28.3 p80 -119.54 24.7 10.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.712 0.767 . . . . 0.0 109.551 174.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -169.59 100.29 0.33 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.087 177.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -71.96 146.62 47.63 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 122.009 0.909 . . . . 0.0 113.1 -170.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -178.77 -44.81 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 178.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 6.1 t60 . . . . . 0 C--O 1.244 0.779 0 CA-C-N 112.973 -1.921 . . . . 0.0 106.91 165.54 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.3 mmt . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p -87.22 -26.2 23.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 169.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.502 HD13 ' O ' ' A' ' 127' ' ' SER . 48.3 tp -147.8 141.13 25.23 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.211 -1.359 . . . . 0.0 108.769 174.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -153.19 92.94 1.66 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.613 0.72 . . . . 0.0 110.637 176.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.45 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 48.2 mm -81.35 126.94 75.28 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.82 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 5' ' ' ILE . 8.4 Cg_exo -71.27 -168.72 0.36 Allowed 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.884 2.389 . . . . 0.0 112.61 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.443 ' CB ' ' HD3' ' A' ' 9' ' ' LYS . 38.9 mt-10 -130.38 156.28 44.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.341 -177.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -79.49 68.0 5.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.815 0.817 . . . . 0.0 109.518 174.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.443 ' HD3' ' CB ' ' A' ' 7' ' ' GLU . 53.1 mtpt -139.25 -143.82 0.17 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.82 -174.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.0 mm -69.37 -2.11 2.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.422 0.63 . . . . 0.0 111.912 -174.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.611 ' HZ1' ' HA ' ' A' ' 14' ' ' SER . 47.3 tttm -159.5 117.22 2.72 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.677 178.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -98.39 -172.99 2.44 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 168.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 40.36 87.22 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 172.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.611 ' HA ' ' HZ1' ' A' ' 11' ' ' LYS . 57.9 m -89.26 11.53 18.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.524 0.678 . . . . 0.0 109.939 175.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 tt -78.79 157.78 4.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.796 175.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.424 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.3 mp -89.19 114.49 27.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 174.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -70.01 121.83 18.18 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 177.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.477 HD11 ' OH ' ' A' ' 109' ' ' TYR . 9.4 mt -105.07 106.83 21.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.675 -174.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.436 ' CG ' ' HB3' ' A' ' 29' ' ' SER . 19.2 mt-30 -102.05 100.43 10.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.024 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.527 HD22 ' HA ' ' A' ' 97' ' ' ASP . 43.9 mt -138.38 156.7 47.35 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 33.3 mtmt -99.98 153.84 18.87 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 120.58 -0.448 . . . . 0.0 111.584 -172.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.76 -166.4 1.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.884 -174.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.543 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 6.3 mp -53.61 -46.77 70.54 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.729 177.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtmm -68.32 -44.76 74.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.974 -179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.479 ' O ' ' HD2' ' A' ' 21' ' ' LYS . . . 124.7 19.53 2.49 Favored Glycine 0 N--CA 1.44 -1.084 0 C-N-CA 120.637 -0.792 . . . . 0.0 111.79 -176.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.468 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.9 OUTLIER -92.32 119.73 32.17 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 175.458 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.585 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 45.5 m -64.93 127.83 33.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.99 0.424 . . . . 0.0 111.31 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.2 mmm180 -108.84 136.32 48.59 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.436 ' HB3' ' CG ' ' A' ' 19' ' ' GLN . 57.3 p -119.0 165.46 14.08 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.629 ' HB3' HD21 ' A' ' 124' ' ' ASN . 64.7 mt -80.99 -28.59 35.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.084 0.469 . . . . 0.0 109.806 177.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 p -63.87 -20.84 66.13 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.086 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -81.38 -44.3 17.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 122.016 0.913 . . . . 0.0 108.572 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.471 HD23 HG13 ' A' ' 38' ' ' VAL . 2.7 tp -80.26 15.86 1.45 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.171 -1.377 . . . . 0.0 110.798 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.575 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 47.3 tttp -69.41 -14.29 62.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.905 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.14 10.73 65.01 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 121.15 -0.548 . . . . 0.0 113.324 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 3.4 mttm -144.97 177.9 8.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.08 0.467 . . . . 0.0 110.389 177.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.636 HG23 ' HD1' ' A' ' 69' ' ' PHE . 14.7 m -92.07 125.84 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 168.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.515 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 38.7 t -107.23 135.71 44.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 112.257 -165.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.612 HD11 HG23 ' A' ' 117' ' ' VAL . 2.0 tm? -96.38 120.22 36.3 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.478 -0.783 . . . . 0.0 108.961 170.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.1 mm -93.95 105.09 16.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 175.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.573 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 31.0 t0 -108.69 135.4 49.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.039 0.447 . . . . 0.0 111.003 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.73 ' HB3' HD21 ' A' ' 114' ' ' LEU . 70.3 m-85 -123.4 115.44 21.62 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.288 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.1 t -155.95 174.13 15.78 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.736 0.303 . . . . 0.0 110.692 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.579 ' HB ' ' OD2' ' A' ' 77' ' ' ASP . 2.0 m -116.44 144.83 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.361 176.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.607 ' H ' ' HB2' ' A' ' 77' ' ' ASP . 15.1 m-85 -102.24 81.03 2.03 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.6 . . . . 0.0 110.72 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.776 HD21 ' HB3' ' A' ' 79' ' ' ASP . 8.1 m-20 177.9 21.68 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.502 -1.681 . . . . 0.0 107.895 178.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -141.34 129.47 22.12 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.592 -163.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.85 78.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.039 -173.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -64.28 -21.24 66.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.011 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 9.0 t -74.64 -27.68 60.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.331 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.57 -51.46 35.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.833 0.349 . . . . 0.0 110.894 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.36 -34.01 77.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.252 0.548 . . . . 0.0 110.44 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.403 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 68.3 t60 -67.45 -35.86 80.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.271 178.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -66.95 -37.3 84.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.608 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.6 tt -64.81 -42.04 95.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.361 -178.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.48 85.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.301 0.572 . . . . 0.0 110.333 177.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.8 mt -66.37 -41.33 89.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.69 176.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.437 ' HA ' ' HZ3' ' A' ' 92' ' ' TRP . 17.0 tpt180 -58.67 -31.94 68.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.102 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -71.83 -55.88 6.76 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 122.813 1.292 . . . . 0.0 107.728 -173.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.8 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -54.51 -31.74 56.67 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 112.124 -2.307 . . . . 0.0 111.388 177.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -76.72 -43.39 37.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.037 -178.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -61.63 -22.05 64.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.323 0.582 . . . . 0.0 110.591 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -85.38 -61.62 1.72 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.546 -178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.569 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 95.7 m-85 -108.23 -8.79 15.64 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -165.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.489 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -65.97 -30.41 70.96 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 121.984 -0.447 . . . . 0.0 111.594 -176.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.8 m -68.24 -18.37 64.54 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.966 0.413 . . . . 0.0 111.038 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.569 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.4 mp0 -91.1 -61.97 1.55 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.425 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -177.4 38.88 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.688 -0.768 . . . . 0.0 111.876 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.636 ' HD1' HG23 ' A' ' 37' ' ' VAL . 73.5 t80 -113.17 145.67 40.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.607 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 9.3 tp10 -145.06 147.03 32.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.163 179.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.575 HD12 ' CE3' ' A' ' 92' ' ' TRP . 59.1 mt -111.79 131.18 63.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.982 0.42 . . . . 0.0 110.297 178.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.505 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 88.5 t80 -114.87 101.37 8.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.203 177.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.573 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 18.4 mt-30 -92.96 136.19 33.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.873 -177.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 56.4 mt -117.59 113.2 41.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.144 176.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 43' ' ' THR . 9.3 m -91.09 119.04 30.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.362 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 18.3 mt -100.97 15.23 29.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.409 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.607 ' HB2' ' H ' ' A' ' 45' ' ' TYR . 4.7 t70 -71.85 166.98 20.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.494 -175.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.95 -18.5 46.92 Favored Glycine 0 N--CA 1.441 -1.017 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.584 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.776 ' HB3' HD21 ' A' ' 46' ' ' ASN . 9.6 t70 -111.19 114.71 28.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.305 0.574 . . . . 0.0 110.951 -178.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.573 ' HB3' ' NH1' ' A' ' 96' ' ' ARG . 11.0 pt-20 -80.15 -20.65 44.41 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.362 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -46.14 81.17 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.565 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -70.2 -34.65 73.19 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.543 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 12.5 t90 -59.86 -59.96 4.6 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.939 173.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -63.25 -40.42 97.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.275 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 59.8 m -68.31 -34.09 75.51 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.406 -178.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t -84.6 -23.36 29.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.062 0.458 . . . . 0.0 110.365 178.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.563 ' HA ' ' HG ' ' A' ' 90' ' ' LEU . . . -81.38 -18.22 46.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.405 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -53.69 -44.58 69.88 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.139 0.495 . . . . 0.0 111.321 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.06 16.45 9.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.851 -178.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.563 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 17.7 mt -86.63 139.09 33.37 Favored Pre-proline 0 N--CA 1.452 -0.374 0 CA-C-O 121.439 0.638 . . . . 0.0 111.895 -179.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.719 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 73.6 Cg_endo -79.13 -30.78 2.51 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.818 3.012 . . . . 0.0 113.485 -176.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.719 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.2 p90 -105.28 -163.26 0.93 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.124 -173.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.64 127.39 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -177.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 26.8 t -129.67 115.91 18.05 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 15.6 m -121.95 177.96 3.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.5 -176.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.573 ' NH1' ' HB3' ' A' ' 80' ' ' GLU . 32.5 ttp180 -129.93 139.14 51.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.571 0.224 . . . . 0.0 110.593 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.527 ' HA ' HD22 ' A' ' 20' ' ' LEU . 18.4 t70 -83.32 151.07 25.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.942 178.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.22 -25.29 34.3 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -175.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -104.83 -12.78 16.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -173.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.73 -87.49 0.17 Allowed Glycine 0 CA--C 1.519 0.311 0 C-N-CA 121.096 -0.573 . . . . 0.0 112.972 177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -107.22 -9.98 15.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.006 0.431 . . . . 0.0 110.973 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -103.01 22.62 13.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.114 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.435 ' HB2' HG13 ' A' ' 106' ' ' ILE . 2.2 m -69.25 133.63 48.15 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.067 -177.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.547 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 14.5 m -57.1 -33.35 67.24 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.311 176.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -56.35 -48.07 77.54 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.393 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.666 HG23 ' CG1' ' A' ' 111' ' ' VAL . 41.9 mt -55.53 -37.42 45.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.666 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 32.8 t -77.92 -22.18 50.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.857 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 104' ' ' SER . 93.9 mt -80.3 -30.65 38.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.469 -177.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.477 ' OH ' HD11 ' A' ' 18' ' ' ILE . 82.7 m-85 -85.46 -19.92 30.52 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.033 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.434 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.1 OUTLIER 54.95 56.58 6.46 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 -162.522 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.666 ' CG1' HG23 ' A' ' 106' ' ' ILE . 8.9 p -58.84 -33.11 48.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.112 -1.404 . . . . 0.0 112.301 -169.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 25.1 m 71.26 -56.02 0.64 Allowed 'General case' 0 CA--C 1.534 0.345 0 O-C-N 123.378 0.424 . . . . 0.0 111.792 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -156.24 164.64 38.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.087 0.47 . . . . 0.0 111.056 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.73 HD21 ' HB3' ' A' ' 42' ' ' PHE . 0.6 OUTLIER -125.49 168.96 12.29 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.64 177.564 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.435 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 3.8 Cg_exo -74.74 158.3 99.0 Favored 'Cis proline' 0 C--N 1.354 0.829 0 C-N-CA 124.039 -1.234 . . . . 0.0 112.015 0.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.499 ' HB2' ' HB2' ' A' ' 42' ' ' PHE . 13.6 m -125.86 155.03 41.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.037 0.446 . . . . 0.0 111.375 -173.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.612 HG23 HD11 ' A' ' 39' ' ' LEU . 5.5 p -144.08 143.48 23.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.31 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.598 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 75.9 m-85 -136.07 162.37 33.08 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.81 HD13 HD11 ' A' ' 136' ' ' LEU . 27.3 tp -111.06 143.66 41.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.515 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 53.5 t -133.84 126.6 51.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.532 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.692 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 1.5 p30 -83.29 167.97 17.12 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 49.2 ptt85 -63.97 1.57 0.65 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -168.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -98.5 7.06 46.64 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.629 HD21 ' HB3' ' A' ' 30' ' ' LEU . 2.7 t-20 60.99 57.33 2.58 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.845 -170.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.692 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 39.8 mt-10 -129.27 145.27 51.39 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.355 179.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.04 110.93 4.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.277 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.502 ' O ' HD13 ' A' ' 3' ' ' LEU . 7.7 m -80.51 -47.6 14.01 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.693 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.21 165.81 10.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.212 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.619 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 12.1 mpt_? -92.2 162.09 14.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 175.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.06 -44.82 92.91 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 121.485 -0.388 . . . . 0.0 112.845 -176.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.639 ' CD ' ' H ' ' A' ' 131' ' ' GLU . 0.2 OUTLIER -68.88 -23.07 64.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.155 0.502 . . . . 0.0 110.481 -179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -92.68 -1.87 56.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.95 -176.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.63 HG21 HD13 ' A' ' 136' ' ' LEU . 96.5 mt -99.54 99.85 9.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.558 0.694 . . . . 0.0 110.302 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.424 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 13.1 ptmm? -60.51 -36.38 78.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.065 176.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.424 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 23.5 t70 -166.0 116.75 1.02 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.353 -176.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.81 HD11 HD13 ' A' ' 119' ' ' LEU . 1.8 tp -75.96 -26.66 57.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.57 -175.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -54.89 -53.43 55.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.719 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -58.53 -51.1 71.31 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.029 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.639 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.66 -54.54 42.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.905 -173.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.8 HD12 HD12 ' A' ' 60' ' ' LEU . 38.5 mt -63.33 -35.23 71.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.796 0.331 . . . . 0.0 111.008 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 145' ' ' GLU . 26.9 ttpp -62.39 -49.8 74.08 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.006 0.431 . . . . 0.0 110.462 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -69.93 -23.73 63.26 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.5 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.639 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 78.4 mt -66.85 -40.26 87.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.104 0.478 . . . . 0.0 110.103 173.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 96.7 mt -70.27 -40.47 74.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.823 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 141' ' ' LYS . 45.2 mt-10 -62.07 -34.44 76.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.042 175.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 47.3 35.59 9.79 Favored Glycine 0 CA--C 1.521 0.407 0 N-CA-C 115.443 0.937 . . . . 0.0 115.443 165.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 37.2 m80 71.52 -8.04 1.12 Allowed 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 173.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -69.34 118.63 12.46 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 118.9 0.773 . . . . 0.0 110.03 -176.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 68.58 7.17 5.88 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.057 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 46.2 m80 67.62 2.33 2.94 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 123.467 0.707 . . . . 0.0 112.74 176.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -170.23 178.23 3.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.42 . . . . 0.0 111.045 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.164 -0.922 . . . . 0.0 109.036 174.234 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.8 ttm . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.904 0.383 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.3 m -110.74 -174.85 2.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.846 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.423 ' HA ' HD22 ' A' ' 3' ' ' LEU . 1.1 tm? -77.01 76.72 3.56 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -117.45 98.66 6.52 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.356 -176.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.438 HG22 ' H ' ' A' ' 7' ' ' GLU . 49.2 mm -105.72 118.59 54.98 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.483 -177.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.76 22.91 0.8 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.037 2.491 . . . . 0.0 113.562 -176.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.438 ' H ' HG22 ' A' ' 5' ' ' ILE . 17.5 mm-40 -99.89 78.37 2.11 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.986 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.416 ' C ' ' HD2' ' A' ' 9' ' ' LYS . 8.6 t70 -82.17 168.77 17.36 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.501 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 12.0 mptt -111.77 -8.27 14.16 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.618 0.723 . . . . 0.0 110.645 -176.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.1 mt -118.59 14.75 7.07 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 114.656 -1.156 . . . . 0.0 107.936 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.462 ' HE2' ' HB3' ' A' ' 11' ' ' LYS . 31.0 ttpt -174.65 56.69 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.284 -1.326 . . . . 0.0 108.872 -173.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -55.38 136.89 49.0 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.341 -179.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 58.14 68.56 0.82 Allowed 'General case' 0 C--O 1.234 0.257 0 O-C-N 123.836 0.71 . . . . 0.0 110.387 -174.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.8 m -70.06 -33.39 71.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.358 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.6 tp -162.23 139.25 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.434 177.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.474 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -100.81 103.68 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -67.49 108.52 2.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.335 0.588 . . . . 0.0 110.521 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 29' ' ' SER . 19.4 mm -87.15 124.2 40.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.645 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.575 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 11.0 mt-30 -120.86 100.43 7.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.89 0.376 . . . . 0.0 111.149 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.3 mt -142.03 153.88 44.56 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.225 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 92.6 mttt -79.81 144.54 33.44 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.244 0.545 . . . . 0.0 110.528 178.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.582 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 3.3 p-10 -90.55 -169.84 2.53 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.04 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.498 ' CD2' ' HA ' ' A' ' 88' ' ' ASP . 37.9 tp -59.0 -36.4 74.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.42 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HB2' HD22 ' A' ' 26' ' ' ASN . 91.6 mttt -69.71 -24.59 63.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.166 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.63 15.22 21.41 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.218 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.543 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 53.7 m-80 -99.51 122.52 42.71 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 17.0 m -66.72 106.87 1.96 Allowed 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 172.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.575 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.8 mmm180 -86.82 142.43 28.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.082 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.54 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 73.8 p -121.72 156.95 32.01 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 172.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.652 ' HB3' HD21 ' A' ' 124' ' ' ASN . 53.7 mt -74.38 -27.02 60.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.091 0.472 . . . . 0.0 109.868 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.8 p -67.81 -14.79 63.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.187 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -91.28 -40.25 11.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.539 0.685 . . . . 0.0 109.446 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.563 HD23 HG13 ' A' ' 38' ' ' VAL . 3.4 tp -77.11 3.65 12.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.346 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 36.9 ttpt -61.22 -18.42 58.23 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.436 -178.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -71.73 -12.39 74.22 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.588 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -123.7 -177.89 3.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.98 0.419 . . . . 0.0 110.103 177.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.684 HG23 ' HD1' ' A' ' 69' ' ' PHE . 5.5 m -93.71 126.75 46.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 167.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.566 ' HB ' ' HB ' ' A' ' 120' ' ' VAL . 22.1 t -102.16 129.45 53.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.255 0.55 . . . . 0.0 112.132 -165.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.727 HD12 ' HZ ' ' A' ' 69' ' ' PHE . 6.2 tt -92.87 110.06 21.51 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 171.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.639 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 35.0 mm -84.74 106.15 14.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.99 0.424 . . . . 0.0 110.31 179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.651 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 5.4 t70 -104.14 134.61 47.11 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.123 178.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.4 ' HB3' HD11 ' A' ' 114' ' ' LEU . 17.0 m-85 -119.54 108.91 15.09 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 171.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.503 ' O ' ' HA ' ' A' ' 75' ' ' SER . 6.4 t -143.85 -175.45 4.59 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.219 0.533 . . . . 0.0 110.75 -174.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.766 HG13 ' HB2' ' A' ' 47' ' ' ASN . 2.5 p -145.12 128.15 10.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.653 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.516 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 30.1 m-85 -78.12 79.4 4.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.853 0.835 . . . . 0.0 109.807 178.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 176.1 -27.56 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 113.543 -1.662 . . . . 0.0 109.687 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.766 ' HB2' HG13 ' A' ' 44' ' ' VAL . 41.7 t-20 -73.21 135.33 44.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.729 -177.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.71 -28.82 68.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.345 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.21 -24.43 63.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.8 m -63.29 -28.98 70.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -176.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.38 -59.62 4.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.833 0.349 . . . . 0.0 111.256 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.05 -32.72 73.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.922 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.428 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 67.8 t60 -62.46 -42.96 99.84 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.022 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -70.04 -21.59 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.662 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.3 -44.02 65.96 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 177.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.31 -36.3 75.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.36 0.6 . . . . 0.0 110.091 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.466 ' HB3' HD13 ' A' ' 71' ' ' ILE . 82.9 mt -65.96 -40.61 91.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.837 176.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.526 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 28.5 tpt180 -60.68 -28.82 68.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.22 177.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.55 -56.97 4.14 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 122.528 1.156 . . . . 0.0 108.148 -171.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.708 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -57.91 -32.48 67.79 Favored 'General case' 0 N--CA 1.425 -1.68 0 CA-C-N 112.348 -2.205 . . . . 0.0 111.515 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -75.65 -44.43 42.6 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.293 0.568 . . . . 0.0 109.647 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 15.1 t30 -59.75 -26.11 65.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.866 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -83.55 -61.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.701 -1.136 . . . . 0.0 112.434 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -105.69 -7.2 18.58 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -163.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.582 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.17 -35.37 69.49 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.12 0.418 . . . . 0.0 111.93 -177.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.3 m -66.21 -12.44 56.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.058 -0.519 . . . . 0.0 112.183 -175.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.445 ' HB2' HD13 ' A' ' 144' ' ' LEU . 50.3 mt-30 -106.27 17.58 23.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.173 -178.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.02 46.39 3.11 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.113 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.727 ' HZ ' HD12 ' A' ' 39' ' ' LEU . 46.9 t80 -120.8 136.24 54.95 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -142.59 142.79 32.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.193 0.52 . . . . 0.0 110.277 -176.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.482 HG23 HD22 ' A' ' 39' ' ' LEU . 60.0 mt -102.52 132.66 48.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.3 -176.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.506 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.7 t80 -115.7 101.2 8.62 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.676 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.651 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 2.0 mt-30 -90.72 128.08 36.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.469 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.3 mt -109.01 109.36 28.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.706 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 43' ' ' THR . 1.1 m -93.94 142.1 27.76 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.454 -178.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.1 mt -115.73 27.79 9.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.835 0.35 . . . . 0.0 110.96 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.4 ' HB3' HG23 ' A' ' 44' ' ' VAL . 3.7 p30 -84.1 178.48 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.871 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -137.73 35.43 2.05 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.983 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -138.36 134.14 33.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.984 0.421 . . . . 0.0 110.363 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -77.45 -31.42 53.81 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -177.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 51.0 m80 -68.79 -51.88 36.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.439 -167.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -71.49 -44.55 64.49 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.516 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 56.7 t90 -59.68 -49.6 77.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.491 -179.221 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 88' ' ' ASP . 51.9 tttm -61.33 -61.72 2.34 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.896 -177.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 16.8 m -55.44 -38.77 69.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.037 -173.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.484 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.4 m -74.48 -39.51 62.42 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.421 -177.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.407 ' HA ' HD12 ' A' ' 90' ' ' LEU . . . -87.44 -20.87 26.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.062 0.458 . . . . 0.0 111.458 -174.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.537 ' HB2' ' O ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -60.0 -35.54 75.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.532 -176.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -96.26 8.52 43.7 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.732 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 86' ' ' SER . 25.6 mt -93.82 149.05 36.4 Favored Pre-proline 0 N--CA 1.451 -0.419 0 CA-C-O 121.249 0.547 . . . . 0.0 111.55 -178.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.581 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 98.6 Cg_endo -74.32 -56.96 0.07 OUTLIER 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.59 2.86 . . . . 0.0 113.86 -175.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.581 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.5 p90 -83.37 -166.5 1.39 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.946 -169.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -87.52 133.32 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.813 -171.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 83.3 m -133.14 110.66 10.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.904 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.582 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 16.0 m -116.34 163.34 13.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.928 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -129.98 144.04 51.12 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.445 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -76.48 162.03 28.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.103 178.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.54 -34.95 65.45 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -177.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.425 ' HA ' HD22 ' A' ' 99' ' ' ASN . 1.0 OUTLIER -122.43 -11.27 8.34 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.561 -0.456 . . . . 0.0 111.751 -174.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.76 -113.72 3.82 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.67 -0.776 . . . . 0.0 113.252 172.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.31 5.58 4.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.851 0.358 . . . . 0.0 111.892 -174.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -110.29 9.51 23.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.973 0.416 . . . . 0.0 110.206 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 14.4 t -63.83 130.2 43.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.127 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.7 m -58.49 -28.95 65.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.699 -177.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.49 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 80.3 m-85 -61.54 -36.9 81.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.007 -177.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.481 HG23 ' HB ' ' A' ' 111' ' ' VAL . 62.3 mt -59.08 -34.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.603 -175.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 41.2 m -80.09 -18.6 49.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.921 0.391 . . . . 0.0 111.115 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.4 mt -81.0 -33.44 33.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.07 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.566 ' HB2' HG23 ' A' ' 111' ' ' VAL . 78.3 m-85 -83.76 -9.43 58.81 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.81 178.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.9 t30 62.6 78.38 0.29 Allowed 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 -168.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.874 HG11 HD12 ' A' ' 114' ' ' LEU . 21.3 t -119.51 89.9 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.228 0 CA-C-O 121.339 0.59 . . . . 0.0 110.306 -178.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 13.4 p -91.59 -4.74 54.98 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.288 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -148.17 84.72 1.52 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.2 0.524 . . . . 0.0 111.427 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.874 HD12 HG11 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -83.08 157.84 65.34 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 170.48 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.606 ' HA ' ' CG ' ' A' ' 114' ' ' LEU . 7.5 Cg_exo -71.24 162.83 87.21 Favored 'Cis proline' 0 C--N 1.352 0.722 0 C-N-CA 124.64 -0.983 . . . . 0.0 113.409 1.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 49.2 m -143.82 173.85 11.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.386 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.83 156.41 17.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.449 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.639 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 78.3 m-85 -146.36 158.68 43.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.772 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 17.7 tp -112.57 145.31 40.56 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.924 -177.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.599 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 34.6 t -138.5 126.12 28.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.645 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -80.92 168.26 18.93 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -76.72 16.3 0.53 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -172.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -105.8 10.59 32.58 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 167.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.652 HD21 ' HB3' ' A' ' 30' ' ' LEU . 1.9 t-20 56.48 63.75 1.88 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.908 -172.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.599 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 46.1 mt-10 -127.46 140.87 51.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.673 176.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.5 tt -69.68 107.75 3.58 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.772 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 52.6 m -74.53 -52.98 10.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.335 -177.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -165.56 164.5 19.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.116 -178.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.583 ' O ' HG13 ' A' ' 133' ' ' ILE . 99.4 mtt180 -102.06 151.62 21.93 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.441 ' O ' ' HB2' ' A' ' 131' ' ' GLU . . . -54.83 155.62 8.39 Favored Glycine 0 N--CA 1.452 -0.237 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 173.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 130' ' ' GLY . 26.2 mm-40 71.84 -40.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.119 0.568 . . . . 0.0 110.742 -172.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.477 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.8 OUTLIER -80.39 -29.86 37.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.954 0.407 . . . . 0.0 110.026 177.131 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 129' ' ' ARG . 51.3 mt -59.52 -44.32 92.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.807 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 132' ' ' ASN . 50.9 mttp 74.29 -58.47 0.58 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.428 0.691 . . . . 0.0 110.851 179.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -139.77 110.47 6.75 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.541 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.888 HD13 HD11 ' A' ' 140' ' ' ILE . 0.3 OUTLIER -77.11 -28.01 54.25 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.11 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.412 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.0 t70 -57.21 -52.27 65.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.693 0.282 . . . . 0.0 111.012 -172.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.46 -34.97 79.13 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.015 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.591 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -63.26 -52.36 62.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.694 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.888 HD11 HD13 ' A' ' 136' ' ' LEU . 30.1 mt -65.15 -40.04 87.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -62.75 -44.22 96.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.845 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -72.02 -19.7 61.81 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 79.1 mt -68.48 -39.76 81.22 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.637 0.732 . . . . 0.0 109.349 171.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.445 HD13 ' HB2' ' A' ' 67' ' ' GLN . 88.4 mt -74.37 -44.58 51.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.918 177.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -71.47 -2.54 17.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.119 176.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -68.8 -15.06 68.53 Favored Glycine 0 C--N 1.333 0.394 0 N-CA-C 111.756 -0.537 . . . . 0.0 111.756 173.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 35.1 p-80 -135.51 86.91 2.28 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -148.85 -177.59 5.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.224 -166.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 65.4 m-70 -135.84 132.09 36.19 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 168.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.555 ' O ' ' HB2' ' A' ' 151' ' ' HIS . 3.2 t60 72.06 140.88 0.05 Allowed 'General case' 0 C--O 1.234 0.287 0 O-C-N 124.36 1.038 . . . . 0.0 108.68 -170.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.555 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 45.8 m170 75.94 -58.03 0.55 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -164.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 69.2 t60 . . . . . 0 C--O 1.246 0.915 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.953 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 120.638 0.256 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.3 m -143.05 -79.5 0.22 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.972 0.415 . . . . 0.0 110.242 -177.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.31 48.62 0.18 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.432 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 1.6 pm0 -82.43 10.48 7.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.643 -179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.8 tt -99.64 100.82 11.7 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.58 174.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -82.69 9.45 4.04 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.657 2.238 . . . . 0.0 113.391 -174.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -86.53 173.83 9.34 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.175 -174.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p30 52.88 21.13 1.87 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.363 1.065 . . . . 0.0 112.03 -178.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -107.75 -170.61 1.72 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.109 176.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.1 pt -90.43 1.72 7.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.917 0.865 . . . . 0.0 109.897 174.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.528 ' HG3' ' OG ' ' A' ' 14' ' ' SER . 19.9 tptm -131.5 83.0 2.07 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.344 -1.298 . . . . 0.0 108.567 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.47 152.33 24.04 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.478 -175.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.93 31.35 19.97 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 123.803 0.689 . . . . 0.0 112.345 174.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.528 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 8.1 m -55.08 -44.45 74.84 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.531 0.682 . . . . 0.0 109.462 174.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.7 tp -159.66 123.02 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.581 174.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.477 ' O ' HD12 ' A' ' 30' ' ' LEU . 95.0 mt -87.6 101.94 11.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.885 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -68.73 107.87 3.18 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.803 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 29' ' ' SER . 23.4 mm -87.93 113.8 25.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.222 -178.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.536 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 80.3 mt-30 -108.78 100.26 9.51 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.377 0.608 . . . . 0.0 110.864 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.641 ' HB2' HG11 ' A' ' 95' ' ' VAL . 45.5 mt -137.99 159.98 40.58 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.587 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 41.6 mttp -89.01 135.4 33.57 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.154 0.502 . . . . 0.0 111.532 -177.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.562 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 21.5 p30 -81.79 -167.26 1.45 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.587 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.705 HD21 ' HB3' ' A' ' 87' ' ' ALA . 91.1 mt -50.33 -35.98 30.08 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -83.86 -6.54 59.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.718 -176.502 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.85 12.76 70.96 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -173.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.543 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.8 OUTLIER -88.06 112.96 23.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.262 -0.469 . . . . 0.0 110.181 -179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.587 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.0 m -61.88 111.38 1.87 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.154 0.502 . . . . 0.0 111.144 177.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.481 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 14.4 mmt180 -90.64 142.52 27.67 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.55 173.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.536 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 79.6 p -119.22 165.6 14.03 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 171.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.76 ' HB3' HD21 ' A' ' 124' ' ' ASN . 62.8 mt -79.61 -24.93 41.63 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 p -68.09 -18.26 64.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.938 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -83.3 -41.36 18.37 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.66 0.743 . . . . 0.0 109.449 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.727 HD23 HG13 ' A' ' 38' ' ' VAL . 4.6 tp -76.1 -7.19 54.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.727 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.603 ' NZ ' ' HB3' ' A' ' 34' ' ' LYS . 1.1 ttpm? -61.17 99.83 0.11 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.128 175.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.88 -30.76 0.21 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -174.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.608 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 86.4 mttt -113.2 177.5 4.61 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 167.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.812 HG23 ' HD1' ' A' ' 69' ' ' PHE . 13.0 m -82.35 130.72 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 167.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.727 HG13 HD23 ' A' ' 33' ' ' LEU . 43.6 t -101.72 124.03 55.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.178 0.514 . . . . 0.0 111.751 -167.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.552 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.4 tp -94.28 112.6 24.4 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.765 175.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.63 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.4 mm -85.2 105.27 13.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.514 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 29.2 t70 -107.8 110.83 22.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.744 -178.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.44 ' HB3' HD13 ' A' ' 114' ' ' LEU . 36.1 m-85 -95.05 105.18 17.08 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.539 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.6 t -137.56 -175.84 4.2 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.402 0.62 . . . . 0.0 111.563 -170.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.559 HG23 ' HB3' ' A' ' 77' ' ' ASP . 0.2 OUTLIER -143.0 122.39 8.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.782 178.654 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.706 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 49.4 m-85 -81.27 79.97 7.8 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 9.7 t30 174.79 -30.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.362 -1.29 . . . . 0.0 108.846 175.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.498 ' HB2' HG13 ' A' ' 44' ' ' VAL . 38.4 t-20 -66.82 134.53 52.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.507 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.27 -30.87 70.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.305 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.8 tpt -64.29 -30.1 71.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.906 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.1 m -68.46 -28.27 66.9 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.356 -176.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.91 -53.75 45.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.864 0.364 . . . . 0.0 110.929 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.73 -27.78 63.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.198 0.523 . . . . 0.0 110.604 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.493 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 86.1 t60 -65.3 -44.23 88.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.041 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.469 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.6 m-20 -66.3 -27.15 67.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.647 -178.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.44 -55.11 34.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.262 0.553 . . . . 0.0 109.839 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.57 -32.92 73.03 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.845 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 92.1 mt -64.45 -39.48 93.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.864 176.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -62.35 -33.34 74.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.492 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.542 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 2.2 tt0 -71.77 -52.61 16.79 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -177.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.815 HD12 HD12 ' A' ' 140' ' ' ILE . 1.5 mm? -51.69 -34.97 40.82 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 112.952 -1.931 . . . . 0.0 111.577 177.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -75.9 -41.52 51.71 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.189 0.518 . . . . 0.0 110.065 -177.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.401 HD22 ' HA ' ' A' ' 62' ' ' ASN . 8.9 m120 -65.28 -21.43 66.72 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.832 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.611 ' HD2' ' HA ' ' A' ' 60' ' ' LEU . 36.3 mttm -80.99 -61.73 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.602 -178.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.428 ' HE1' ' HG3' ' A' ' 141' ' ' LYS . 71.1 m-85 -111.21 -10.91 14.27 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -163.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.597 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -61.88 -31.31 71.58 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.307 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.5 m -64.18 -24.88 67.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.978 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -96.12 -6.93 37.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.027 0.442 . . . . 0.0 110.67 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.426 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 117.27 64.41 0.33 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.638 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.812 ' HD1' HG23 ' A' ' 37' ' ' VAL . 34.4 t80 -134.44 141.93 46.95 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 177.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.664 ' HG2' HD11 ' A' ' 33' ' ' LEU . 7.9 tp10 -140.24 148.6 41.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.351 -178.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.569 ' HB ' ' CG ' ' A' ' 92' ' ' TRP . 48.0 mt -112.51 124.93 69.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.018 0.437 . . . . 0.0 109.963 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.581 ' CE1' HG21 ' A' ' 95' ' ' VAL . 88.2 t80 -109.86 100.43 9.41 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.514 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.4 mt-30 -92.2 135.43 34.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.092 0.472 . . . . 0.0 111.29 -178.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 68.2 mt -117.95 110.77 31.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.458 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.73 ' HB2' ' OD1' ' A' ' 77' ' ' ASP . 34.6 p -85.35 136.95 33.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.689 0.28 . . . . 0.0 111.114 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.462 HD22 ' H ' ' A' ' 101' ' ' ALA . 50.8 mt -105.39 13.74 29.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.812 0.339 . . . . 0.0 110.829 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.73 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 2.2 p-10 -86.47 163.04 17.78 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.969 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -98.09 -29.06 7.8 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.768 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.477 ' OD1' ' HB3' ' A' ' 81' ' ' HIS . 13.5 t0 -76.45 110.19 10.79 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.397 0.618 . . . . 0.0 110.669 -178.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.604 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 32.1 tt0 -70.93 -19.94 62.52 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.334 -179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . 0.477 ' HB3' ' OD1' ' A' ' 79' ' ' ASP . 0.0 OUTLIER -71.53 -45.04 63.48 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.835 -175.756 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -71.14 -44.95 64.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.977 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.517 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 39.2 t90 -55.9 -42.84 76.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.354 172.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.604 ' HB2' ' O ' ' A' ' 80' ' ' GLU . 11.5 tppt? -60.91 -57.47 12.52 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.96 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.2 p -65.14 -41.42 94.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.296 -174.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.401 ' HB2' ' HD2' ' A' ' 45' ' ' TYR . 38.2 m -67.69 -37.46 82.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.424 -178.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.705 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -86.58 -17.74 33.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.604 -177.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -50.18 -35.04 24.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.039 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -109.76 16.04 22.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.536 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 87' ' ' ALA . 27.8 mt -89.63 146.88 36.53 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 121.144 0.497 . . . . 0.0 111.525 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.709 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 93.1 Cg_endo -79.96 -40.49 0.23 Allowed 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 123.694 2.929 . . . . 0.0 114.027 -176.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.709 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.0 p90 -96.15 -168.09 1.69 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.783 0.325 . . . . 0.0 111.627 -170.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.411 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 24.8 t -81.61 120.29 32.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 121.148 0.499 . . . . 0.0 110.528 -171.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 35.0 m -116.3 106.54 13.77 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.956 -176.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.641 HG11 ' HB2' ' A' ' 20' ' ' LEU . 7.9 t -121.29 159.69 23.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.463 -172.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.567 HH12 ' HB2' ' A' ' 80' ' ' GLU . 54.0 ttp180 -120.34 141.78 49.73 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.763 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.527 ' HA ' HD13 ' A' ' 20' ' ' LEU . 30.4 t70 -73.2 160.53 31.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.321 177.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.79 -28.43 33.21 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -174.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.484 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 33.4 t30 -122.49 -12.69 8.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 120.261 -0.576 . . . . 0.0 112.46 -172.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.55 84.72 0.23 Allowed Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.651 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.462 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 75.19 -32.78 0.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.46 0.704 . . . . 0.0 111.926 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.484 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 52.3 m-85 -86.28 37.04 0.71 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.066 0.46 . . . . 0.0 110.016 176.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.432 ' HB3' HG13 ' A' ' 106' ' ' ILE . 23.1 t -87.22 136.73 32.82 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.346 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.8 m -61.83 -29.25 70.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.06 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -64.79 -41.42 95.84 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.843 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.432 HG13 ' HB3' ' A' ' 103' ' ' SER . 71.7 mt -56.81 -38.78 60.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.165 -178.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 36.1 t -68.91 -28.62 66.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.758 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.43 -26.68 61.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.94 0.4 . . . . 0.0 110.56 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -83.85 -1.55 54.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 68.92 5.21 4.89 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.805 0.812 . . . . 0.0 110.198 -177.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.615 HG11 ' HG ' ' A' ' 114' ' ' LEU . 8.7 t -58.49 119.86 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.882 -174.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 3.4 m -110.12 -4.59 15.72 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.616 174.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -149.41 114.24 5.37 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.343 -176.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.621 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 53.8 mt -118.86 165.6 16.42 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 170.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.621 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.18 158.89 91.82 Favored 'Cis proline' 0 C--N 1.352 0.75 0 CA-C-N 119.614 0.898 . . . . 0.0 113.582 1.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.1 m -155.22 164.3 38.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.012 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 4.0 p -125.43 154.05 33.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.63 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 69.1 m-85 -132.35 161.86 32.52 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 176.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.692 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.4 tp -110.85 131.67 54.85 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.946 -176.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 23.0 t -129.31 127.4 65.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 174.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.475 ' HB3' HD22 ' A' ' 143' ' ' LEU . 8.0 p30 -83.78 170.76 13.82 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.029 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -60.81 -12.67 11.54 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 124.272 0.983 . . . . 0.0 113.544 -164.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -95.71 13.46 26.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.76 HD21 ' HB3' ' A' ' 30' ' ' LEU . 1.6 t-20 61.01 54.78 3.28 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.841 -174.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.474 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.9 mm-40 -122.25 137.36 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.54 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 126' ' ' LEU . 10.0 mt -68.49 112.27 5.21 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 0.0 110.437 175.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.692 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 24.4 m -81.37 -55.02 4.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.005 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -168.33 172.39 8.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.992 0.425 . . . . 0.0 111.46 -175.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.677 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -93.94 161.88 14.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.44 -0.8 . . . . 0.0 108.96 176.001 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.507 ' HA2' HD12 ' A' ' 133' ' ' ILE . . . -48.05 -48.99 24.91 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 114.7 0.64 . . . . 0.0 114.7 -172.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.443 ' HG2' HD22 ' A' ' 132' ' ' ASN . 0.0 OUTLIER -74.85 -26.87 59.99 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 117.028 0.414 . . . . 0.0 110.739 -176.747 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.443 HD22 ' HG2' ' A' ' 131' ' ' GLU . 0.9 OUTLIER -72.35 -34.18 67.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.877 175.416 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.888 HG21 ' HG ' ' A' ' 136' ' ' LEU . 49.1 mt -69.46 -40.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.56 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.587 ' HG3' ' C ' ' A' ' 133' ' ' ILE . 0.0 OUTLIER 48.45 -86.51 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.287 0.992 . . . . 0.0 112.023 -173.273 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -88.43 84.78 6.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.093 -176.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.888 ' HG ' HG21 ' A' ' 133' ' ' ILE . 4.6 mp -60.6 -32.53 71.65 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.719 -178.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -52.85 -56.09 18.36 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.812 0.339 . . . . 0.0 110.365 175.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.33 -41.64 93.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.777 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -58.09 -54.88 42.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.614 -177.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.815 HD12 HD12 ' A' ' 60' ' ' LEU . 35.8 mt -65.35 -35.23 74.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.862 0.363 . . . . 0.0 110.948 -177.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.428 ' HG3' ' HE1' ' A' ' 64' ' ' TYR . 3.5 ttmp? -60.15 -42.52 95.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.156 0.503 . . . . 0.0 109.991 177.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -82.84 -18.4 40.54 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.861 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 55.7 mt -62.2 -38.42 89.09 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.419 0.628 . . . . 0.0 109.544 170.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 44.5 mt -84.63 -59.35 2.39 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.158 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -109.81 25.94 11.22 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -171.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -126.19 68.57 0.52 Allowed Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 119.801 -1.19 . . . . 0.0 113.75 -175.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -135.04 120.27 18.92 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.132 0.492 . . . . 0.0 110.558 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -86.01 74.58 10.09 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.369 0.604 . . . . 0.0 111.151 -173.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -138.88 0.64 2.0 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 169.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.472 ' O ' ' HB2' ' A' ' 151' ' ' HIS . 10.9 t-80 -178.25 -65.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.236 -1.347 . . . . 0.0 108.346 -175.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.472 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 52.9 t-80 166.15 -43.5 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 177.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 . . . . . 0 C--O 1.25 1.108 0 CA-C-N 113.396 -1.729 . . . . 0.0 107.474 170.144 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 120.601 0.239 . . . . 0.0 110.785 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.0 t -85.19 -64.47 1.15 Allowed 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.1 tp -79.1 86.47 4.92 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 174.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -107.96 99.75 9.17 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.9 tp -118.83 99.61 51.13 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.555 -175.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -73.95 178.58 6.68 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.688 2.259 . . . . 0.0 112.526 -178.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -110.98 95.98 5.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.896 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -141.92 176.45 8.93 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.472 -175.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.417 ' O ' ' HG3' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -77.07 -174.64 3.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.355 -177.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.569 ' O ' ' HB3' ' A' ' 11' ' ' LYS . 50.6 mm -55.28 130.85 17.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 173.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.569 ' HB3' ' O ' ' A' ' 10' ' ' ILE . 38.8 tttm 76.18 77.92 0.09 Allowed 'General case' 0 N--CA 1.465 0.286 0 O-C-N 124.021 0.826 . . . . 0.0 109.851 -171.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 9' ' ' LYS . 0.5 OUTLIER -96.21 -161.37 0.86 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.804 178.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 62.25 12.46 5.18 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.19 174.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.6 m -86.2 2.17 47.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.254 0.55 . . . . 0.0 110.478 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.502 HD13 HG11 ' A' ' 120' ' ' VAL . 4.9 tp -159.96 139.57 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.991 -179.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.416 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.1 mp -94.39 102.73 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 168.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.92 132.47 44.4 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.403 ' H ' ' HG ' ' A' ' 30' ' ' LEU . 8.4 mt -113.61 105.54 18.94 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.25 -176.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.0 OUTLIER -93.88 101.44 13.52 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.267 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.507 ' HB2' HG11 ' A' ' 95' ' ' VAL . 78.4 mt -137.54 155.66 48.99 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.4 mtmt -89.0 137.99 31.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.495 0.664 . . . . 0.0 111.425 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.619 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -87.64 -169.89 2.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.87 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.677 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 36.5 tp -48.33 -39.52 22.27 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.603 0.761 . . . . 0.0 112.716 -178.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.9 mtmm -74.98 -13.6 60.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.999 0.428 . . . . 0.0 111.738 -177.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 89.63 17.25 55.17 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 111.166 -0.774 . . . . 0.0 111.166 -175.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.473 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.9 OUTLIER -99.56 127.56 45.64 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.667 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.5 m -67.97 113.78 5.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.491 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 16.5 mmm180 -92.45 142.29 27.58 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.441 ' O ' ' HB3' ' A' ' 32' ' ' ASP . 2.0 m -134.31 163.66 29.15 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 174.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.487 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 65.4 mt -80.08 -32.88 39.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.553 -172.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.7 p -64.21 -14.32 54.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.018 0.437 . . . . 0.0 111.116 173.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 29' ' ' SER . 6.9 t0 -82.6 -45.07 15.03 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -76.35 0.13 20.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.473 -1.24 . . . . 0.0 110.659 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.5 ' HA ' HD22 ' A' ' 124' ' ' ASN . 7.4 ttpm? -58.26 134.58 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.736 178.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 121.69 -29.88 5.5 Favored Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 -174.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.581 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 61.4 mttm -112.38 166.15 11.55 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.761 HG23 ' HD1' ' A' ' 69' ' ' PHE . 8.5 m -84.27 124.44 39.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 170.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.626 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 99.4 t -102.06 132.03 48.86 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 121.641 0.734 . . . . 0.0 111.045 -169.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.645 HD22 HG23 ' A' ' 71' ' ' ILE . 6.4 tt -94.38 104.27 16.25 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 172.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.441 HG13 ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -88.46 104.34 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.634 -0.826 . . . . 0.0 109.281 178.339 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.571 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.2 t70 -103.26 142.02 34.9 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.065 -175.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 -124.3 95.93 4.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 173.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.442 ' O ' ' HA ' ' A' ' 75' ' ' SER . 13.7 t -123.7 -175.71 3.28 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.296 -174.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.561 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.2 OUTLIER -137.78 111.51 8.34 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.08 0.467 . . . . 0.0 110.628 178.85 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.492 ' CD1' ' HB2' ' A' ' 75' ' ' SER . 41.7 m-85 -72.55 79.18 1.06 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 51.4 t30 172.51 -25.59 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.224 -177.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.561 ' HB2' HG13 ' A' ' 44' ' ' VAL . 5.6 t-20 -82.29 150.15 27.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.643 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.02 -30.95 62.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.373 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -71.77 -20.17 61.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.75 -176.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.0 m -63.97 -24.69 67.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 120.623 0.249 . . . . 0.0 111.329 -178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.05 -50.23 74.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.802 0.334 . . . . 0.0 111.269 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.61 -31.94 60.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.103 0.478 . . . . 0.0 110.814 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.41 ' HE2' ' CG ' ' A' ' 41' ' ' ASP . 86.3 t60 -63.72 -45.11 91.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.715 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.71 -18.78 62.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.836 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.3 tt -73.85 -44.31 55.92 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.95 -37.77 77.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.395 0.616 . . . . 0.0 109.882 175.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.87 -40.31 91.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.926 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.478 ' O ' ' HB2' ' A' ' 62' ' ' ASN . 13.1 tpt180 -56.14 -35.96 67.72 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.958 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -77.55 -50.96 11.49 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -172.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.912 HD12 HD12 ' A' ' 140' ' ' ILE . 1.9 mm? -55.97 -31.34 62.9 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 113.262 -1.79 . . . . 0.0 111.441 178.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.416 ' HD1' HG13 ' A' ' 71' ' ' ILE . 23.9 t80 -82.83 -44.03 15.96 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.387 0.613 . . . . 0.0 109.876 -178.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 29.1 t30 -60.65 -24.82 65.86 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.116 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -85.95 -60.67 1.95 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.815 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -104.57 -12.51 16.4 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -164.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.552 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -60.41 -31.77 70.7 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -174.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 m -60.35 -28.73 68.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.168 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.555 ' HG3' HD13 ' A' ' 144' ' ' LEU . 9.2 pt20 -108.68 29.77 7.12 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 99.02 48.62 1.71 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.067 -1.063 . . . . 0.0 112.852 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.761 ' HD1' HG23 ' A' ' 37' ' ' VAL . 37.3 t80 -132.23 140.5 48.7 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.426 ' OE1' HG23 ' A' ' 93' ' ' VAL . 0.3 OUTLIER -140.62 151.2 44.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -178.493 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.645 HG23 HD22 ' A' ' 39' ' ' LEU . 65.2 mt -114.24 111.0 34.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.714 0.769 . . . . 0.0 110.394 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.537 ' CE1' HG21 ' A' ' 95' ' ' VAL . 91.5 t80 -96.56 99.17 10.82 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 178.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.571 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 8.4 tt0 -100.96 114.35 28.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.349 -171.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.413 HD11 ' HE2' ' A' ' 72' ' ' TYR . 50.0 mt -96.71 124.6 49.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.218 177.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.492 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 27.9 t -96.93 137.95 35.23 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.904 0.383 . . . . 0.0 110.472 177.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 31.0 mt -112.08 34.32 4.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.653 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.421 ' OD2' ' HD3' ' A' ' 96' ' ' ARG . 3.6 p30 -82.92 -176.16 6.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.449 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -139.7 35.98 1.88 Allowed Glycine 0 N--CA 1.444 -0.773 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.45 176.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -145.35 115.83 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.359 0.599 . . . . 0.0 110.995 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.505 ' HA ' HH12 ' A' ' 96' ' ' ARG . 4.9 tp10 -64.65 -36.0 82.84 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.096 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -61.51 -56.38 20.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.585 -170.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -68.55 -41.05 80.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.76 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.677 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 53.2 t90 -60.81 -55.12 36.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.545 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.412 ' HE2' HD12 ' A' ' 23' ' ' LEU . 2.6 ttmt -57.32 -46.93 82.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.899 0.381 . . . . 0.0 111.362 -176.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 21.3 m -70.2 -42.47 72.3 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.804 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.6 t -75.43 -42.38 53.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.05 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.601 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -64.59 -32.13 73.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.863 0.363 . . . . 0.0 110.99 -178.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.53 -27.84 68.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.413 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.61 -1.99 42.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.528 -176.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.476 HD12 ' OH ' ' A' ' 45' ' ' TYR . 26.8 mt -96.7 148.59 34.66 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 121.171 0.51 . . . . 0.0 112.229 -176.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.618 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 89.4 Cg_endo -74.41 -51.79 0.13 Allowed 'Trans proline' 0 N--CA 1.478 0.611 0 C-N-CA 124.128 3.219 . . . . 0.0 114.423 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.618 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 7.4 p90 -83.57 -178.95 7.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.627 -172.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.426 HG23 ' OE1' ' A' ' 70' ' ' GLU . 99.1 t -70.2 125.19 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 121.294 0.568 . . . . 0.0 111.052 -173.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.601 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 1.8 p -113.97 105.21 12.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.396 -176.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.619 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 1.7 t -115.36 161.51 14.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.379 -172.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.505 HH12 ' HA ' ' A' ' 80' ' ' GLU . 46.9 ttp180 -140.49 140.12 35.25 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.255 170.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -93.94 149.33 21.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.63 175.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.65 -1.75 47.84 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -173.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -110.01 -12.49 14.53 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.106 -0.371 . . . . 0.0 111.702 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 67.21 -117.1 8.66 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.119 -178.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -91.63 25.15 2.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.86 0.362 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -130.22 17.27 5.52 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.419 178.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.543 ' HB2' HG13 ' A' ' 106' ' ' ILE . 10.5 m -61.96 134.55 56.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.204 -178.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.485 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 4.0 m -55.78 -35.22 66.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.012 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -57.08 -47.56 80.72 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 177.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.543 HG13 ' HB2' ' A' ' 103' ' ' SER . 68.2 mt -57.93 -37.76 62.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.928 -177.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 16.0 m -70.33 -36.19 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.898 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.5 mt -66.01 -34.87 79.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.305 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -71.44 -29.75 65.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.667 0.27 . . . . 0.0 110.853 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.7 77.68 0.29 Allowed 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -163.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.445 HG11 ' CG2' ' A' ' 106' ' ' ILE . 7.4 p -90.49 152.93 3.27 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.491 -174.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 8.6 m -72.99 -43.4 62.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 173.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.423 ' H ' HG22 ' A' ' 111' ' ' VAL . 10.4 p30 174.84 169.83 0.27 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.154 178.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.547 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 3.6 mm? -118.96 162.26 32.22 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 175.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.547 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.7 Cg_endo -73.36 153.5 99.17 Favored 'Cis proline' 0 C--N 1.35 0.607 0 C-N-CA 123.811 -1.329 . . . . 0.0 113.163 0.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.431 ' HB2' HD13 ' A' ' 114' ' ' LEU . 30.4 m -151.13 178.57 9.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.383 -177.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.617 HG12 ' HA3' ' A' ' 130' ' ' GLY . 4.3 p -139.36 162.21 27.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.441 ' HB2' HG13 ' A' ' 40' ' ' ILE . 91.6 m-85 -144.27 157.17 44.42 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 174.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.871 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 14.7 tp -112.77 144.92 41.48 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.079 -0.248 . . . . 0.0 110.681 -177.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 126' ' ' LEU . 5.1 m -141.67 140.5 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 120.853 0.359 . . . . 0.0 110.9 169.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.63 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 5.3 p30 -80.49 173.83 12.21 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.603 ' HG3' HG13 ' A' ' 37' ' ' VAL . 98.2 mtt180 -52.55 -30.03 28.53 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 114.147 1.165 . . . . 0.0 114.147 -171.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -76.79 4.93 8.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.094 0.474 . . . . 0.0 110.243 177.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.5 HD22 ' HA ' ' A' ' 34' ' ' LYS . 3.2 m-80 58.44 61.95 2.11 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.221 -173.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.63 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 46.1 mt-10 -124.94 132.18 53.32 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.85 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.643 ' HA ' HG12 ' A' ' 120' ' ' VAL . 1.2 tt -58.91 113.39 2.05 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 123.895 0.747 . . . . 0.0 110.504 -174.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.871 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 66.6 m -77.88 -55.29 5.43 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.581 -179.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.64 ' HB1' HD21 ' A' ' 132' ' ' ASN . . . -172.71 171.48 4.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.299 177.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.622 ' HD3' ' OE2' ' A' ' 131' ' ' GLU . 57.9 mtt180 -90.48 144.91 25.33 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.11 -178.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.617 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -64.48 -17.77 62.55 Favored Glycine 0 C--N 1.319 -0.387 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 172.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.622 ' OE2' ' HD3' ' A' ' 129' ' ' ARG . 10.9 mt-10 -64.94 -24.71 67.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.099 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.64 HD21 ' HB1' ' A' ' 128' ' ' ALA . 1.6 p-10 -118.49 -23.14 7.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.562 179.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.56 HD11 ' HB3' ' A' ' 128' ' ' ALA . 70.5 mt -79.41 101.85 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.919 0.39 . . . . 0.0 110.461 177.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.474 ' H ' ' HG2' ' A' ' 134' ' ' LYS . 11.3 ptmm? -84.76 -32.35 23.47 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -121.61 93.29 3.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.538 ' O ' HG13 ' A' ' 140' ' ' ILE . 5.8 mp -75.85 -25.52 56.29 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.228 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.574 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.1 t70 -49.37 -58.01 5.88 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 123.433 0.458 . . . . 0.0 110.931 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -60.7 -42.98 98.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.813 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.516 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -57.81 -53.1 61.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.456 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.912 HD12 HD12 ' A' ' 60' ' ' LEU . 33.7 mt -64.54 -40.56 89.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.889 0.376 . . . . 0.0 110.949 -178.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 145' ' ' GLU . 26.9 ttpp -58.92 -47.28 85.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.436 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.638 ' HA ' ' HG2' ' A' ' 145' ' ' GLU . 32.3 mtmt -68.41 -20.47 64.67 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.766 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 87.5 mt -72.8 -40.81 65.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.263 0.554 . . . . 0.0 110.239 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.555 HD13 ' HG3' ' A' ' 67' ' ' GLN . 97.6 mt -79.02 -44.04 23.04 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.334 -176.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.638 ' HG2' ' HA ' ' A' ' 142' ' ' LYS . 11.0 pt-20 -64.81 -38.06 89.73 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.99 -178.12 40.95 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.83 176.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -75.53 -23.12 56.61 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 175.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -108.94 90.75 3.39 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 172.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -51.92 107.3 0.19 Allowed 'General case' 0 N--CA 1.464 0.256 0 O-C-N 123.791 0.682 . . . . 0.0 111.673 -176.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -89.87 88.66 7.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.046 -176.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 70.39 8.92 6.81 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.288 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . 0.413 ' CE1' ' HA ' ' A' ' 145' ' ' GLU . 3.0 p80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.524 -0.751 . . . . 0.0 109.916 175.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.482 1.136 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.3 t -116.57 -150.02 0.45 Allowed 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 173.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.0 tp -91.08 67.65 5.98 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 173.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.599 ' HG2' HD13 ' A' ' 5' ' ' ILE . 2.4 pt-20 -87.15 5.08 39.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.285 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.599 HD13 ' HG2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -128.06 101.63 22.44 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.778 179.195 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.535 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 11.9 Cg_exo -72.55 -132.7 0.01 OUTLIER 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.874 2.383 . . . . 0.0 112.9 174.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.515 ' OE1' ' HB3' ' A' ' 14' ' ' SER . 4.9 mm-40 62.91 32.38 15.74 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 122.229 1.014 . . . . 0.0 108.616 -172.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.418 ' OD2' ' HB2' ' A' ' 12' ' ' GLU . 7.4 p-10 -87.44 95.81 10.15 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 113.821 -1.536 . . . . 0.0 111.743 -173.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.445 ' HE2' ' HB2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER 44.9 130.91 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 179.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.1 mt 52.68 -107.5 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.544 -1.207 . . . . 0.0 109.233 -171.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.581 ' HD2' ' HB2' ' A' ' 14' ' ' SER . 24.9 mmtm -156.93 83.05 0.94 Allowed 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 123.82 0.848 . . . . 0.0 110.09 172.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HB2' ' OD2' ' A' ' 8' ' ' ASP . 61.3 mm-40 -91.86 -92.87 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.436 0.636 . . . . 0.0 111.061 -178.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.35 14.3 4.54 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.404 -0.817 . . . . 0.0 109.725 175.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.581 ' HB2' ' HD2' ' A' ' 11' ' ' LYS . 0.9 OUTLIER -90.21 -158.66 0.55 Allowed 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 114.701 -1.136 . . . . 0.0 109.89 -176.61 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.613 HD11 HD13 ' A' ' 30' ' ' LEU . 4.9 tp -94.87 124.36 47.34 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.306 175.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.467 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.4 mp -66.55 120.04 12.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.66 -177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -71.66 107.69 4.63 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.057 0.456 . . . . 0.0 110.017 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.678 ' O ' ' HA ' ' A' ' 29' ' ' SER . 12.9 mt -106.18 110.3 30.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.872 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.548 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 95.1 mt-30 -107.47 101.4 10.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.122 0.486 . . . . 0.0 111.33 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.59 ' HB2' HG11 ' A' ' 95' ' ' VAL . 28.4 mt -137.19 157.99 45.44 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 174.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.721 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 47.9 mttm -94.8 158.95 15.27 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.391 0.615 . . . . 0.0 111.675 -175.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -95.44 -169.74 2.03 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.39 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.775 HD11 ' HB1' ' A' ' 87' ' ' ALA . 6.4 mp -52.97 -41.5 64.62 Favored 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.6 0.562 . . . . 0.0 111.844 -176.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.565 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 67.5 mttm -81.3 -16.62 51.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.1 -175.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.47 6.88 40.81 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.959 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.565 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 2.2 m-80 -80.99 126.36 31.29 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 176.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 6.3 m -74.86 112.82 11.47 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.959 0.409 . . . . 0.0 110.637 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HG3' HG13 ' A' ' 93' ' ' VAL . 3.6 mmm-85 -100.49 143.47 30.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.678 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.2 p -127.42 175.93 7.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.278 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.613 HD13 HD11 ' A' ' 15' ' ' ILE . 97.2 mt -78.9 -10.95 59.97 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.632 ' HA ' ' HB2' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -88.46 2.27 53.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.334 169.524 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.476 ' HB2' ' H ' ' A' ' 29' ' ' SER . 29.1 t70 -95.94 -33.51 12.15 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.91 HD13 HG21 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -111.47 18.24 19.33 Favored 'General case' 0 C--O 1.249 1.073 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.762 173.298 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.632 ' HB2' ' HA ' ' A' ' 31' ' ' THR . 56.4 tttp -70.93 66.64 0.38 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.202 179.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -149.41 -23.63 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.032 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.863 -178.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.735 ' HD3' ' HB2' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -137.76 -174.41 3.77 Favored 'General case' 0 N--CA 1.44 -0.936 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.95 174.62 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.748 HG22 ' H ' ' A' ' 122' ' ' ARG . 54.6 t -72.17 118.27 16.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.518 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -176.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.91 HG21 HD13 ' A' ' 33' ' ' LEU . 78.0 t -117.55 132.46 67.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-O 122.038 0.923 . . . . 0.0 113.257 -168.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.562 ' HB3' HG23 ' A' ' 71' ' ' ILE . 2.2 tt -81.14 123.49 28.47 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.944 -1.48 . . . . 0.0 110.274 171.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.588 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 5.6 mm -99.42 105.54 17.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 173.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.484 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 16.5 t70 -108.55 132.69 53.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.025 0.44 . . . . 0.0 111.582 -175.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.639 ' HB3' HD21 ' A' ' 114' ' ' LEU . 62.8 m-85 -121.64 109.82 15.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.529 174.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 t -150.06 176.82 10.45 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.695 HG23 ' HB2' ' A' ' 47' ' ' ASN . 17.8 m -119.59 113.27 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.64 175.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.812 ' CD1' ' HB2' ' A' ' 75' ' ' SER . 33.6 m-85 -67.72 84.77 0.2 Allowed 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.673 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 45' ' ' TYR . 57.2 t30 174.04 -35.65 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 122.098 0.951 . . . . 0.0 109.228 -172.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.695 ' HB2' HG23 ' A' ' 44' ' ' VAL . 9.4 t-20 -85.07 143.09 29.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.25 -1.341 . . . . 0.0 111.265 -172.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.94 -31.55 69.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.367 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.8 mtp -65.56 -24.33 67.07 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.184 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 8.5 t -81.47 -23.87 37.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.562 -176.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.58 -56.9 14.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.844 0.354 . . . . 0.0 110.827 -178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.78 -27.46 65.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.597 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 83.6 t60 -66.7 -45.64 78.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.614 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.503 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.4 m-20 -67.05 -27.91 67.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.23 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -61.13 -56.22 23.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.133 0.492 . . . . 0.0 109.896 176.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.43 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . -59.43 -33.38 71.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.021 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 96.3 mt -63.34 -40.8 98.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 110.136 176.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.865 HH21 ' HD3' ' A' ' 91' ' ' PRO . 14.5 ttm180 -64.89 -29.94 70.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.048 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -74.01 -51.82 14.69 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.473 ' CD1' ' HB3' ' A' ' 136' ' ' LEU . 22.7 mt -55.71 -35.91 66.6 Favored 'General case' 0 N--CA 1.427 -1.58 0 CA-C-N 111.742 -2.481 . . . . 0.0 111.336 177.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -73.02 -48.36 36.93 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.684 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -62.56 -22.35 66.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.637 178.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -79.32 -57.65 3.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.135 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.466 ' HA ' ' NE2' ' A' ' 67' ' ' GLN . 84.7 m-85 -112.6 -8.68 13.81 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -164.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.568 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -57.48 -43.0 83.74 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -173.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.4 m -67.84 -16.23 64.0 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.755 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.466 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 1.1 mp0 -93.88 -0.53 55.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.739 0.304 . . . . 0.0 110.736 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.69 50.6 0.52 Allowed Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.498 -0.858 . . . . 0.0 111.814 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.568 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 80.8 t80 -130.45 136.14 48.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.122 0.487 . . . . 0.0 110.749 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.735 ' HB2' ' HD3' ' A' ' 36' ' ' LYS . 7.5 tp10 -135.7 159.94 40.08 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.461 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.562 HG23 ' HB3' ' A' ' 39' ' ' LEU . 48.5 mt -131.0 130.15 63.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.007 0.432 . . . . 0.0 110.231 -176.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.842 ' HB2' HD21 ' A' ' 33' ' ' LEU . 77.1 t80 -117.79 101.17 8.1 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 177.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.484 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 57.8 tt0 -105.8 121.52 44.21 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.303 -172.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.426 HD11 ' HE2' ' A' ' 72' ' ' TYR . 60.0 mt -101.88 130.31 51.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.421 -178.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.812 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 35.7 t -102.99 112.33 25.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.128 172.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.809 HD11 HD22 ' A' ' 114' ' ' LEU . 2.3 pp -113.22 28.47 8.76 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.89 0.376 . . . . 0.0 111.201 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.547 ' HB2' ' HB ' ' A' ' 44' ' ' VAL . 19.0 t70 -65.89 -73.91 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.554 0.692 . . . . 0.0 110.319 176.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 146.35 -27.58 1.68 Allowed Glycine 0 N--CA 1.44 -1.041 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.892 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -85.67 131.34 34.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.24 0.543 . . . . 0.0 111.572 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -79.14 -38.97 34.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.52 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -68.96 -39.97 79.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.858 -165.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -77.97 -34.73 50.84 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 -176.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.598 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 22.7 t90 -62.19 -57.6 10.89 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.604 175.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -64.54 -38.91 92.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.928 -0.309 . . . . 0.0 111.691 -171.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -67.18 -43.53 81.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.999 0.428 . . . . 0.0 110.977 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.566 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 20.9 m -70.55 -24.37 62.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.811 178.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.775 ' HB1' HD11 ' A' ' 23' ' ' LEU . . . -87.8 -25.66 23.24 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.506 0.669 . . . . 0.0 110.099 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.3 -13.63 62.24 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.572 -177.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -103.36 -3.49 25.45 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.832 174.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 86' ' ' SER . 41.4 mt -94.03 148.94 36.1 Favored Pre-proline 0 N--CA 1.447 -0.622 0 CA-C-O 121.361 0.6 . . . . 0.0 111.649 -175.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.865 ' HD3' HH21 ' A' ' 58' ' ' ARG . 24.7 Cg_endo -90.54 -37.95 0.05 OUTLIER 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 124.156 3.237 . . . . 0.0 113.875 -173.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.653 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 5.8 p90 -87.57 -169.05 2.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.206 -171.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.557 HG13 ' HG3' ' A' ' 28' ' ' ARG . 38.0 t -78.89 99.39 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-O 121.087 0.47 . . . . 0.0 110.112 -173.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.599 ' HB2' HD11 ' A' ' 23' ' ' LEU . 22.1 m -97.57 113.19 24.86 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.603 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.62 HG21 ' CE1' ' A' ' 72' ' ' TYR . 1.9 t -119.45 153.19 22.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.511 -170.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.463 ' HB2' ' CE2' ' A' ' 83' ' ' TRP . 7.8 tmm_? -124.02 140.0 53.4 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.456 ' HA ' HD13 ' A' ' 20' ' ' LEU . 16.1 t70 -81.92 158.61 23.88 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 -173.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.36 -34.53 31.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 112.028 -175.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.32 -12.66 8.59 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.159 -174.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 80.27 -120.17 5.12 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.688 175.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.09 -6.17 32.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 111.55 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -104.15 16.97 25.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.133 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.486 ' HB3' HG13 ' A' ' 106' ' ' ILE . 24.2 t -65.08 133.1 50.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.49 -178.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.484 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 12.0 m -62.53 -26.91 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.186 -178.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.459 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 88.5 m-85 -63.53 -42.63 98.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.982 0.42 . . . . 0.0 110.019 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.797 HG23 HG23 ' A' ' 111' ' ' VAL . 52.3 mt -52.94 -42.27 43.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.999 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 13.8 m -71.93 -20.39 61.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.341 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 104' ' ' SER . 97.6 mt -81.2 -38.48 26.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.661 0.267 . . . . 0.0 111.406 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.575 ' HB2' HG22 ' A' ' 111' ' ' VAL . 77.3 m-85 -79.55 -25.21 41.72 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.882 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 90.12 23.2 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 178.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.797 HG23 HG23 ' A' ' 106' ' ' ILE . 3.3 m -85.14 148.02 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.23 0 CA-C-N 113.268 -1.787 . . . . 0.0 109.691 176.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 9.0 t -155.1 20.54 0.43 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.943 0.401 . . . . 0.0 111.07 -177.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -146.01 -62.0 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.949 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.809 HD22 HD11 ' A' ' 76' ' ' LEU . 2.4 mp 69.95 169.77 0.11 Allowed Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.473 -177.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.519 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 3.9 Cg_exo -72.38 166.86 79.03 Favored 'Cis proline' 0 C--N 1.353 0.801 0 C-N-CA 123.712 -1.37 . . . . 0.0 111.914 -0.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.4 m -145.17 157.32 44.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.89 -177.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.548 ' O ' ' HA3' ' A' ' 130' ' ' GLY . 1.3 p -134.98 155.43 38.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.588 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 89.7 m-85 -145.56 153.57 41.23 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.856 ' HB3' ' HB3' ' A' ' 127' ' ' SER . 8.5 tp -122.07 150.35 42.26 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 118.488 -1.285 . . . . 0.0 112.217 -178.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.58 HG12 ' HA ' ' A' ' 126' ' ' LEU . 13.7 m -136.93 143.79 34.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.749 169.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.582 ' HB3' HD22 ' A' ' 143' ' ' LEU . 5.0 p30 -110.48 153.79 24.55 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.748 ' H ' HG22 ' A' ' 37' ' ' VAL . 21.4 ttp-105 49.8 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.785 1.303 . . . . 0.0 113.173 167.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.401 ' H ' ' HB3' ' A' ' 122' ' ' ARG . 9.4 m120 -97.56 30.54 2.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.768 -176.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.567 ' CB ' ' HG3' ' A' ' 34' ' ' LYS . 1.2 t-20 58.68 53.88 5.69 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.998 -178.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.569 ' HG3' ' ND2' ' A' ' 121' ' ' ASN . 1.6 pt-20 -109.08 128.73 55.24 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.379 173.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.58 ' HA ' HG12 ' A' ' 120' ' ' VAL . 0.3 OUTLIER -52.07 116.4 2.17 Favored 'General case' 0 C--N 1.329 -0.286 0 O-C-N 123.688 0.618 . . . . 0.0 111.192 -173.619 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.856 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 24.8 t -71.76 -61.56 1.74 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.663 178.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.11 164.34 18.04 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.771 179.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.553 ' HB3' ' OE1' ' A' ' 131' ' ' GLU . 7.3 mmm180 -75.37 147.5 39.98 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 1.048 ' HA2' HG12 ' A' ' 133' ' ' ILE . . . -67.33 -21.74 72.43 Favored Glycine 0 CA--C 1.508 -0.385 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.985 -175.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.553 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.9 mp0 -67.1 -12.39 59.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.361 0.601 . . . . 0.0 109.547 173.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -117.62 -1.53 11.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.163 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 1.048 HG12 ' HA2' ' A' ' 130' ' ' GLY . 16.5 mm -84.39 94.79 3.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 177.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.411 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 14.7 ptmm? -50.27 -51.78 41.85 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.383 0.611 . . . . 0.0 110.206 176.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.411 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 4.8 m-20 -144.35 126.64 15.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.927 HD22 HG21 ' A' ' 133' ' ' ILE . 0.2 OUTLIER -58.85 -38.86 79.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.412 ' HB2' HD21 ' A' ' 60' ' ' LEU . 9.5 t70 -49.09 -58.42 4.98 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.771 176.064 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.01 -40.96 70.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.414 179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.616 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.914 -175.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.705 HD11 HD12 ' A' ' 136' ' ' LEU . 24.1 mt -60.64 -46.08 96.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.691 0.758 . . . . 0.0 110.037 176.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.447 ' HB3' ' HE2' ' A' ' 141' ' ' LYS . 17.2 ttpt -56.99 -39.09 74.01 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.559 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.569 ' HE3' ' HA ' ' A' ' 139' ' ' ALA . 17.9 pttp -84.39 -19.94 32.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.526 179.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 13.8 mt -81.52 -29.56 33.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 -175.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 87.0 mt -52.64 -42.14 64.4 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.356 0.598 . . . . 0.0 110.179 178.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.683 ' HB3' ' CD2' ' A' ' 151' ' ' HIS . 18.7 mm-40 -86.46 15.06 5.81 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.916 178.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 72.52 -63.13 1.48 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.64 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 77.41 -6.95 1.92 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.021 0.928 . . . . 0.0 112.715 171.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 8.0 p80 -126.81 105.88 8.96 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.823 -0.751 . . . . 0.0 111.617 178.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 81.8 t60 70.92 -9.2 0.86 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.005 -0.998 . . . . 0.0 112.461 174.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -157.09 144.39 18.74 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.683 ' CD2' ' HB3' ' A' ' 145' ' ' GLU . 0.2 OUTLIER -92.1 -93.28 0.15 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 175.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . 0.452 ' H ' ' HB3' ' A' ' 151' ' ' HIS . 4.5 p-80 . . . . . 0 C--O 1.244 0.771 0 CA-C-O 118.315 -0.85 . . . . 0.0 108.916 173.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 mmt . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.485 0.183 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.5 m -160.14 -78.49 0.06 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.81 0.338 . . . . 0.0 111.071 -177.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -125.82 43.15 3.14 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.522 -173.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -84.15 18.11 2.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.849 0.356 . . . . 0.0 111.008 177.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 22.6 pt -66.9 117.44 45.44 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.412 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.458 ' HD2' ' OE1' ' A' ' 7' ' ' GLU . 84.0 Cg_endo -81.97 4.97 6.63 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.493 2.129 . . . . 0.0 114.406 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.458 ' OE1' ' HD2' ' A' ' 6' ' ' PRO . 2.9 pm0 -85.67 46.07 1.27 Allowed 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 121.26 0.552 . . . . 0.0 110.539 177.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -76.27 80.68 3.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.987 -177.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? 62.37 -172.0 0.16 Allowed 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.97 -1.014 . . . . 0.0 112.373 176.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.0 mt 64.9 -100.96 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.888 176.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.597 ' HD2' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -157.07 8.12 0.18 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.944 0.878 . . . . 0.0 109.289 -175.746 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.44 ' O ' ' HA ' ' A' ' 7' ' ' GLU . 14.3 mm-40 -80.84 147.18 30.53 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.048 -168.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.34 -99.42 0.1 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.35 -171.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 m 60.6 17.04 7.06 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.255 0.55 . . . . 0.0 111.449 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.579 HG21 ' O ' ' A' ' 124' ' ' ASN . 9.0 pt -93.66 177.27 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.116 -178.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.443 HG21 ' HD1' ' A' ' 105' ' ' TYR . 63.9 mt -111.2 104.59 17.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -76.1 107.38 8.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.475 0.655 . . . . 0.0 109.659 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.605 ' O ' ' HA ' ' A' ' 29' ' ' SER . 28.4 mm -83.38 126.0 40.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.622 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.639 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 38.5 mt-30 -129.45 95.27 3.97 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.822 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.559 HD22 ' C ' ' A' ' 19' ' ' GLN . 1.1 mm? -129.58 159.95 34.79 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 54.5 mtmt -85.68 143.8 28.18 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.093 0.473 . . . . 0.0 110.453 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.506 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 23.2 p30 -80.72 -171.13 2.97 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.457 -178.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.656 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 3.3 tm? -50.51 -41.27 53.3 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.187 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.428 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 74.1 mmtt -75.73 -41.63 52.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.986 0.422 . . . . 0.0 110.977 -179.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 15.65 2.42 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.645 -177.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.454 ' HB2' ' OD2' ' A' ' 22' ' ' ASP . 26.3 m-80 -87.92 118.05 27.2 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.8 m -64.59 107.52 1.42 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.201 0.524 . . . . 0.0 110.032 177.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.639 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 9.4 mmt180 -92.26 135.41 34.03 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.505 176.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.605 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 69.8 p -112.78 158.23 20.37 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 169.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.455 HD22 HG11 ' A' ' 38' ' ' VAL . 81.9 mt -68.1 -28.43 67.34 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.603 ' HA ' ' OD1' ' A' ' 124' ' ' ASN . 5.8 p -66.56 -17.14 64.65 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.037 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -81.85 -23.14 36.58 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.846 0.831 . . . . 0.0 109.171 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.62 HD23 HG13 ' A' ' 38' ' ' VAL . 2.4 tp -96.57 2.1 51.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.659 -1.155 . . . . 0.0 110.119 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -57.23 112.69 1.45 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.961 179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 143.2 -41.97 1.12 Allowed Glycine 0 N--CA 1.446 -0.671 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 122' ' ' ARG . 60.7 mttp -100.53 171.04 7.97 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.675 HG23 ' HD1' ' A' ' 69' ' ' PHE . 11.5 m -81.92 124.65 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 170.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.62 HG13 HD23 ' A' ' 33' ' ' LEU . 47.5 t -101.64 120.06 50.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.743 -170.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.582 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.5 tp -85.94 110.1 19.21 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 175.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.622 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 26.8 mm -84.38 105.12 13.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.509 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 10.3 t70 -108.52 110.65 22.2 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.68 -177.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.576 ' HB3' HD13 ' A' ' 114' ' ' LEU . 26.3 m-85 -98.23 100.31 11.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.781 174.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.485 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 14.7 t -136.27 -174.78 3.78 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.472 -176.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.635 ' CG1' ' HB3' ' A' ' 47' ' ' ASN . 12.0 p -133.18 133.03 58.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 177.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 1.026 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 42.4 m-85 -87.67 78.83 8.4 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -176.25 -38.55 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.849 177.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.635 ' HB3' ' CG1' ' A' ' 44' ' ' VAL . 5.0 t30 -90.07 133.24 34.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.519 -174.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.49 -22.39 32.33 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.514 -0.766 . . . . 0.0 112.987 -173.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.7 mtt -56.86 -30.36 63.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.868 0.366 . . . . 0.0 110.85 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.0 t -73.06 -23.03 60.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.949 -177.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.7 -58.78 5.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.797 0.332 . . . . 0.0 111.167 -175.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.61 -31.42 68.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.26 0.552 . . . . 0.0 110.457 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.428 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.3 t60 -60.01 -41.7 92.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.726 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.6 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.2 m-20 -71.29 -20.91 62.15 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.795 -179.101 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.7 tt -72.47 -43.32 63.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.93 -37.35 82.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.384 0.612 . . . . 0.0 110.041 175.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 54' ' ' ASN . 91.0 mt -65.19 -41.43 94.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.805 176.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -57.49 -32.06 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.84 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.68 -55.44 5.65 Favored 'General case' 0 CA--C 1.493 -1.24 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.795 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.61 -32.41 63.08 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 112.757 -2.019 . . . . 0.0 111.23 178.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -74.47 -47.86 30.87 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.223 0.535 . . . . 0.0 109.852 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.65 -20.75 66.48 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.685 -179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -78.82 -60.46 2.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.989 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.524 ' HB3' HD11 ' A' ' 144' ' ' LEU . 92.3 m-85 -114.29 -5.93 12.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 113.939 1.089 . . . . 0.0 113.939 -164.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.55 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -55.36 -38.05 68.31 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.299 0.499 . . . . 0.0 111.964 -175.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.2 p -66.65 -16.38 64.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.031 -176.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.483 ' HB2' HD13 ' A' ' 144' ' ' LEU . 3.6 mm-40 -96.65 4.45 51.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.793 0.33 . . . . 0.0 110.758 -174.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.87 45.78 1.25 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.622 -176.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.675 ' HD1' HG23 ' A' ' 37' ' ' VAL . 41.9 t80 -125.96 135.34 51.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.748 0.309 . . . . 0.0 110.3 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -140.43 147.5 39.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.971 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' A' ' 92' ' ' TRP . 55.8 mt -107.97 129.91 61.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.044 0.45 . . . . 0.0 110.082 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.417 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 83.1 t80 -110.8 99.83 8.68 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.509 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 19.3 tt0 -100.59 123.3 44.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.929 -173.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.407 ' HA ' ' O ' ' A' ' 95' ' ' VAL . 27.6 mt -110.38 127.22 67.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.302 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 1.026 ' HB3' ' HD1' ' A' ' 45' ' ' TYR . 0.1 OUTLIER -84.97 141.52 30.29 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.177 0.298 . . . . 0.0 110.301 172.3 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.534 HD11 ' CD1' ' A' ' 114' ' ' LEU . 47.3 mt -96.0 -3.46 44.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.251 0.548 . . . . 0.0 111.058 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.457 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 5.8 p-10 -90.36 -170.57 2.79 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.433 -174.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -136.47 29.18 2.81 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 173.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.33 125.88 41.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.882 0.372 . . . . 0.0 110.237 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.2 -43.87 23.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.66 -177.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.7 p80 -69.05 -42.95 75.61 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.162 -166.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -79.12 -38.23 36.63 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.278 -177.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.656 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 31.5 t90 -61.64 -51.25 69.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.06 0.457 . . . . 0.0 109.979 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.615 ' HA ' HD21 ' A' ' 23' ' ' LEU . 50.2 tttm -63.08 -52.85 61.09 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.219 -175.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.7 m -59.1 -35.17 72.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.995 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.477 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 24.2 t -85.17 -43.29 13.96 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.262 -178.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.601 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -80.67 -25.1 38.45 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -171.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -57.9 -31.86 67.16 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.824 0.345 . . . . 0.0 111.837 -175.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -109.29 13.98 24.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.467 -177.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.496 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 17.9 mt -76.95 148.71 79.22 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-O 121.281 0.562 . . . . 0.0 111.937 -177.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.69 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -73.21 -41.5 1.26 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.648 2.899 . . . . 0.0 113.233 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.69 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.1 p90 -95.35 -171.72 2.47 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.837 0.351 . . . . 0.0 111.466 -175.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.8 t -82.94 132.99 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.152 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.601 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 3.9 p -130.93 110.6 11.39 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.929 -176.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.506 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 15.6 m -123.53 162.02 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.421 ' O ' HD12 ' A' ' 20' ' ' LEU . 52.4 ttp180 -124.03 129.87 51.63 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.136 -0.625 . . . . 0.0 112.271 -178.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -106.5 111.29 23.78 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 171.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -71.22 -2.19 15.16 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.964 0.411 . . . . 0.0 111.318 -175.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -103.35 10.05 37.63 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.23 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.505 ' HA3' ' HB3' ' A' ' 76' ' ' LEU . . . -64.26 76.14 0.06 OUTLIER Glycine 0 CA--C 1.522 0.521 0 N-CA-C 114.425 0.53 . . . . 0.0 114.425 -173.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 168.54 -29.74 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 124.649 1.18 . . . . 0.0 107.974 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -126.2 14.4 7.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.946 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.525 ' HB3' HG13 ' A' ' 106' ' ' ILE . 7.4 t -70.12 135.18 48.93 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.635 -171.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.463 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 1.4 m -54.11 -33.4 57.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.03 -177.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.502 ' HB3' ' HE2' ' A' ' 109' ' ' TYR . 29.8 m-85 -68.67 -44.45 74.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.25 -175.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.525 HG13 ' HB3' ' A' ' 103' ' ' SER . 66.3 mt -53.25 -46.34 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.837 -173.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 11.2 m -67.84 -31.12 70.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.95 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.0 mt -70.28 -26.83 63.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 0.0 110.751 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.616 ' O ' ' HB3' ' A' ' 110' ' ' ASN . 84.0 m-85 -81.8 -2.68 51.71 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.121 178.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.616 ' HB3' ' O ' ' A' ' 109' ' ' TYR . 3.2 t30 80.77 -8.81 1.41 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.039 0.837 . . . . 0.0 109.788 -177.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.626 HG11 ' HG ' ' A' ' 114' ' ' LEU . 76.4 t -54.7 120.98 2.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.803 -1.089 . . . . 0.0 112.531 -171.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 6.3 m -89.32 -34.81 16.42 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.997 174.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -152.71 132.53 13.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.192 179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.743 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 88.6 mt -100.02 174.8 2.75 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.846 174.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.743 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 59.0 Cg_endo -70.84 156.47 95.71 Favored 'Cis proline' 0 C--N 1.362 1.249 0 CA-C-N 120.77 1.311 . . . . 0.0 114.028 1.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 69.1 m -156.88 146.38 20.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.83 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.497 HG12 ' HA3' ' A' ' 130' ' ' GLY . 3.3 p -103.91 156.93 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.622 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 77.0 m-85 -141.09 164.97 28.84 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.967 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 10.7 tp -111.73 138.53 48.18 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 121.17 -0.212 . . . . 0.0 110.531 -175.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.465 ' HB ' ' HB ' ' A' ' 38' ' ' VAL . 4.9 t -131.13 117.79 38.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.22 0.533 . . . . 0.0 110.005 171.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -69.15 161.39 29.21 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.635 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.543 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 25.3 mtm180 -53.94 -20.69 6.49 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -171.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.526 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 56.0 t30 -83.46 5.09 25.01 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.603 ' OD1' ' HA ' ' A' ' 31' ' ' THR . 1.4 m120 63.64 60.68 1.07 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.664 -167.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.532 ' HA ' HG21 ' A' ' 15' ' ' ILE . 56.3 mt-10 -126.2 118.15 24.57 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.283 -0.872 . . . . 0.0 110.352 179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.462 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.9 OUTLIER -57.58 109.04 0.63 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.392 0.615 . . . . 0.0 109.36 176.368 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.967 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 50.3 m -82.43 -48.59 10.92 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.486 -172.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -175.7 172.93 2.46 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.286 -178.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.575 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 78.7 mtt85 -90.89 156.65 17.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.074 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.497 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -59.33 -38.58 93.55 Favored Glycine 0 C--O 1.228 -0.221 0 C-N-CA 121.521 -0.371 . . . . 0.0 112.567 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.575 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.2 OUTLIER -79.46 -19.21 50.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.109 0.48 . . . . 0.0 110.285 179.46 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.532 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -86.59 -19.58 29.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.511 0.672 . . . . 0.0 109.498 179.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.505 HD11 ' HB2' ' A' ' 119' ' ' LEU . 83.2 mt -92.28 123.27 44.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.562 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -57.12 -45.09 83.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.692 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.593 ' OD2' ' HB2' ' A' ' 138' ' ' GLU . 2.4 p-10 -156.61 128.66 7.36 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.565 ' O ' HG13 ' A' ' 140' ' ' ILE . 6.8 mp -75.31 -25.87 58.21 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.594 -174.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.518 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.0 t70 -50.74 -58.38 6.05 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 123.475 0.485 . . . . 0.0 109.931 174.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.593 ' HB2' ' OD2' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -55.96 -41.69 75.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.12 175.888 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.402 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -65.32 -52.61 52.9 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.82 -175.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.795 HD12 HD12 ' A' ' 60' ' ' LEU . 45.8 mt -59.96 -42.34 89.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.61 0.719 . . . . 0.0 109.878 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.9 ttpt -57.58 -40.03 78.1 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.331 -179.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 4.2 ptpp? -84.67 -24.67 28.9 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.945 -178.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 30.8 mt -66.45 -40.72 89.59 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-O 120.958 0.409 . . . . 0.0 110.164 175.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 64' ' ' TYR . 95.9 mt -60.72 -44.17 96.95 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.948 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -69.93 -65.62 0.7 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.078 176.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.18 -74.5 1.65 Allowed Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 -167.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 65.71 21.48 11.58 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.304 0.642 . . . . 0.0 111.856 168.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 149' ' ' HIS . 2.2 p-80 -167.37 72.36 0.11 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.253 0.549 . . . . 0.0 111.434 175.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . 0.403 ' HB2' ' O ' ' A' ' 148' ' ' HIS . 8.5 t-160 177.7 -35.75 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 46.1 m-70 -113.66 -164.64 0.94 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 167.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 34.8 t60 -74.56 -19.68 60.24 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 166.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 . . . . . 0 C--O 1.247 0.922 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.593 172.851 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.482 1.144 0 CA-C-O 120.821 0.343 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.8 p -94.83 155.85 16.62 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.172 177.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.2 tp -82.49 75.89 9.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.402 0.62 . . . . 0.0 109.738 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -90.61 85.02 5.98 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.159 -177.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 64.9 mt -117.77 101.09 52.35 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.486 175.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -76.35 -5.49 16.22 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.769 2.313 . . . . 0.0 112.717 -178.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -81.3 88.15 6.09 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.175 -177.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -100.1 0.12 40.09 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.894 0.855 . . . . 0.0 110.524 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.943 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 26.4 ttpp -157.49 174.76 14.89 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.744 -1.116 . . . . 0.0 108.74 176.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.417 ' H ' ' CG ' ' A' ' 9' ' ' LYS . 17.5 pt -64.97 -3.8 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -167.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.7 tppp? -168.88 25.79 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.344 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.943 ' HG2' ' HB3' ' A' ' 9' ' ' LYS . 22.0 mm-40 -107.59 105.14 14.88 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.262 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.45 100.79 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 O-C-N 124.164 0.915 . . . . 0.0 111.615 178.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.7 t -133.27 138.16 46.33 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -177.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 tp -129.98 121.36 51.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.335 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.458 175.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.765 ' H ' HD13 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -90.18 136.26 24.3 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.582 177.881 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -104.7 107.61 18.65 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 178.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.61 ' O ' ' HA ' ' A' ' 29' ' ' SER . 33.8 mt -92.47 110.53 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.252 -175.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -108.63 100.64 9.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.131 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.717 ' HB2' HG11 ' A' ' 95' ' ' VAL . 39.1 mt -139.33 166.4 24.64 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.685 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 34.2 mttm -96.5 150.26 20.82 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 121.129 0.49 . . . . 0.0 110.988 177.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.571 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.4 OUTLIER -82.55 -171.88 3.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.192 179.104 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 1.039 HD13 ' HA ' ' A' ' 88' ' ' ASP . 1.0 OUTLIER -49.28 -44.74 44.24 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.807 177.991 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.0 mttp -79.83 -20.41 46.13 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.011 -176.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.61 7.92 27.19 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.059 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -82.58 113.31 20.21 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.965 0.412 . . . . 0.0 110.377 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.685 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 24.9 m -69.76 119.86 14.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.171 0.51 . . . . 0.0 110.956 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.542 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 14.8 mmm180 -110.27 138.67 46.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.773 177.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.61 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 12.0 p -119.39 164.27 15.97 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 174.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.548 HD22 HG11 ' A' ' 38' ' ' VAL . 33.5 mt -80.3 -34.03 37.14 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.415 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.5 p -65.05 -16.78 63.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.226 176.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -78.2 -37.49 45.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.865 0.841 . . . . 0.0 109.082 177.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.478 HD23 HG13 ' A' ' 38' ' ' VAL . 3.7 tp -81.44 5.65 16.99 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.487 -1.233 . . . . 0.0 111.427 -173.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -62.83 114.73 3.81 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.126 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 147.71 -39.74 1.0 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 -174.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.638 ' CD ' ' HB2' ' A' ' 70' ' ' GLU . 84.6 mttt -104.15 170.89 7.65 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 172.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.795 HG23 ' HD1' ' A' ' 69' ' ' PHE . 15.8 m -83.57 125.95 40.14 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 168.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.548 HG11 HD22 ' A' ' 30' ' ' LEU . 59.8 t -101.64 123.74 54.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.312 0.577 . . . . 0.0 111.664 -168.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 39' ' ' LEU . 12.4 tp -89.25 121.27 31.38 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.113 172.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.588 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 0.7 OUTLIER -97.91 105.13 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.457 177.812 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.604 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 12.7 t70 -102.36 128.68 48.83 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.411 -177.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -121.77 97.7 5.61 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 176.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.803 ' O ' ' HA ' ' A' ' 75' ' ' SER . 31.1 m -138.66 147.41 42.81 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.758 -170.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.575 HG12 ' HG ' ' A' ' 76' ' ' LEU . 29.7 m -96.04 119.54 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-O 121.315 0.578 . . . . 0.0 109.998 173.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.528 ' CD1' ' HD1' ' A' ' 83' ' ' TRP . 5.5 m-85 -73.01 85.34 1.29 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.97 177.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 t30 173.94 -36.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.638 -172.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -74.04 150.87 40.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.613 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.89 -29.67 68.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -173.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 50.3 mtt -66.75 -20.48 65.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.601 0.239 . . . . 0.0 110.504 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.1 t -58.67 -29.17 66.39 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.109 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.63 -55.2 21.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.96 0.41 . . . . 0.0 110.89 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.66 -30.86 64.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.53 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 82.5 t60 -69.49 -37.53 77.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -63.29 -38.62 91.88 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.282 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.13 -52.02 65.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.15 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.53 90.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.137 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 89.7 mt -62.9 -42.07 99.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.2 0.524 . . . . 0.0 109.912 176.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -60.84 -31.75 71.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.919 178.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.429 ' HG2' ' HE3' ' A' ' 63' ' ' LYS . 7.7 tt0 -75.94 -56.15 4.94 Favored 'General case' 0 CA--C 1.489 -1.389 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 -172.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.833 HD12 HD12 ' A' ' 140' ' ' ILE . 2.1 mm? -54.69 -32.2 59.08 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 112.417 -2.174 . . . . 0.0 111.289 178.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 t80 -77.96 -50.62 11.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.139 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.412 HD22 ' N ' ' A' ' 62' ' ' ASN . 1.0 OUTLIER -65.14 -21.78 66.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.045 0.45 . . . . 0.0 110.865 -176.871 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HE3' ' HG2' ' A' ' 59' ' ' GLU . 89.8 mttt -77.3 -55.08 5.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.113 177.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.576 ' HB3' HD11 ' A' ' 144' ' ' LEU . 94.0 m-85 -113.79 -9.26 13.14 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -164.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.567 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -54.56 -43.34 71.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -174.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.403 ' HB2' ' OE1' ' A' ' 67' ' ' GLN . 12.2 m -67.77 -18.62 64.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.824 -175.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.437 ' NE2' ' HA ' ' A' ' 64' ' ' TYR . 0.9 OUTLIER -95.45 4.8 52.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.811 -179.108 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 108.59 51.57 0.7 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.637 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.795 ' HD1' HG23 ' A' ' 37' ' ' VAL . 56.6 t80 -127.85 143.07 51.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.615 0.245 . . . . 0.0 110.386 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.638 ' HB2' ' CD ' ' A' ' 36' ' ' LYS . 8.7 tp10 -141.38 147.63 38.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.134 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.464 HD12 ' CE3' ' A' ' 92' ' ' TRP . 68.3 mt -112.96 117.77 56.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.156 0.503 . . . . 0.0 110.09 175.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.524 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 81.0 t80 -100.74 99.93 10.54 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 175.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.604 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 12.0 tm0? -91.12 143.37 26.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.828 -173.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.425 HD11 ' HE2' ' A' ' 72' ' ' TYR . 65.5 mt -136.86 121.61 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.803 ' HA ' ' O ' ' A' ' 43' ' ' THR . 89.3 p -99.99 121.13 40.88 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-O 121.524 0.678 . . . . 0.0 110.973 177.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.6 HD13 HD11 ' A' ' 106' ' ' ILE . 0.6 OUTLIER -101.56 43.29 1.07 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -77.48 -169.76 1.55 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.326 -1.306 . . . . 0.0 111.648 -174.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -129.18 21.39 5.2 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.603 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.413 ' OD2' ' HB2' ' A' ' 81' ' ' HIS . 28.0 t70 -162.64 115.14 1.63 Allowed 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.304 0.573 . . . . 0.0 110.236 -177.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.553 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 18.1 tt0 -77.35 -14.33 59.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.157 -176.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . 0.413 ' HB2' ' OD2' ' A' ' 79' ' ' ASP . 56.3 m80 -68.68 -56.85 6.79 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.793 -176.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -60.61 -47.86 84.35 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 120.859 0.362 . . . . 0.0 110.067 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.528 ' CH2' ' HB2' ' A' ' 96' ' ' ARG . 39.5 t90 -55.51 -52.45 63.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.506 179.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.553 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 24.9 ttmt -65.8 -47.77 73.98 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.421 -174.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.8 p -62.98 -34.96 78.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.03 0.443 . . . . 0.0 111.317 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.1 m -78.43 -48.5 15.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.452 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.82 ' HB3' HD21 ' A' ' 23' ' ' LEU . . . -88.79 -21.05 23.97 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.409 1.263 . . . . 0.0 114.409 -168.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 1.039 ' HA ' HD13 ' A' ' 23' ' ' LEU . 28.2 t70 -57.93 -31.12 66.51 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -168.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -101.58 16.22 26.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.34 -176.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.572 ' HG ' ' HA ' ' A' ' 87' ' ' ALA . 25.9 mt -81.25 157.65 70.44 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.09 0.472 . . . . 0.0 111.745 -178.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.628 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 56.1 Cg_endo -64.24 -52.15 1.72 Allowed 'Trans proline' 0 N--CA 1.477 0.536 0 C-N-CA 124.148 3.232 . . . . 0.0 113.575 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.628 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 13.1 p90 -89.55 179.02 6.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.227 0.537 . . . . 0.0 111.668 -173.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.542 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 48.4 t -76.48 123.68 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.102 -176.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.773 ' HB2' HD11 ' A' ' 23' ' ' LEU . 62.5 m -116.98 109.08 16.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.126 0.488 . . . . 0.0 110.131 -178.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.717 HG11 ' HB2' ' A' ' 20' ' ' LEU . 11.1 t -114.73 159.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.304 -172.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.528 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 31.3 ttt180 -122.02 142.15 50.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.737 0.303 . . . . 0.0 110.579 179.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -83.6 142.72 30.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.19 177.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.38 -5.58 58.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -172.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 12.7 m120 -119.95 -13.73 9.0 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.051 -0.66 . . . . 0.0 112.568 -175.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 57.24 82.71 0.05 OUTLIER Glycine 0 CA--C 1.522 0.525 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.339 174.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.555 ' H ' ' HB2' ' A' ' 76' ' ' LEU . . . 74.35 -29.06 0.19 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.436 0.694 . . . . 0.0 111.556 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -85.38 21.57 1.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.537 ' HB3' HG13 ' A' ' 106' ' ' ILE . 38.3 t -61.56 144.51 54.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.811 -173.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.552 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 15.9 m -72.75 -29.89 63.7 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.741 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.413 ' HA ' HD12 ' A' ' 108' ' ' LEU . 88.2 m-85 -68.71 -40.7 79.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.445 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.6 HD11 HD13 ' A' ' 76' ' ' LEU . 74.2 mt -55.49 -34.3 34.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.834 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 19.5 m -80.44 -27.14 38.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.0 mt -68.55 -42.09 78.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.268 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.575 ' OH ' HG13 ' A' ' 16' ' ' ILE . 37.2 m-85 -80.58 -20.4 43.43 Favored 'General case' 0 CA--C 1.519 -0.249 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.501 178.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.55 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER 62.42 67.55 0.71 Allowed 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -169.0 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 40.6 t -78.39 132.48 32.29 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.824 -176.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 20.5 p -71.02 -47.33 59.28 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.025 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -172.44 129.57 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.241 0.543 . . . . 0.0 111.132 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.466 ' HG ' ' CD1' ' A' ' 76' ' ' LEU . 3.9 mm? -80.66 158.92 70.37 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.651 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.488 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 12.5 Cg_exo -73.42 156.02 99.65 Favored 'Cis proline' 0 C--N 1.349 0.57 0 C-N-CA 123.69 -1.379 . . . . 0.0 112.418 -0.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.5 m -140.26 170.08 16.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.286 -177.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.5 p -143.35 155.75 16.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.836 178.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.588 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 90.2 m-85 -138.1 157.73 45.75 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.697 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -111.46 141.85 44.49 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -177.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.532 HG23 HD11 ' A' ' 40' ' ' ILE . 6.8 t -138.7 129.4 34.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 174.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.639 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 4.6 p30 -85.45 170.61 12.51 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.063 178.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.531 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 13.4 ptt180 -52.72 -23.2 6.26 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -170.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -81.61 3.29 25.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.733 0.302 . . . . 0.0 110.24 -176.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.411 HD22 ' HA ' ' A' ' 124' ' ' ASN . 2.1 t-20 65.93 53.28 1.13 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.598 -171.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.639 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 41.3 mt-10 -124.73 137.66 54.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.916 178.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 4.2 tt -68.18 109.31 3.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.318 0.58 . . . . 0.0 109.606 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.697 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 23.4 m -71.55 -57.84 4.04 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.237 -177.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.01 171.83 15.93 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.78 -175.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.584 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -98.75 146.06 26.29 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.783 -178.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -50.39 -26.69 10.09 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 121.528 -0.367 . . . . 0.0 113.041 178.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -63.77 -44.06 94.53 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.978 0.511 . . . . 0.0 111.592 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -104.51 -6.63 20.44 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -170.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.783 HG21 ' HG ' ' A' ' 136' ' ' LEU . 80.2 mt -76.57 100.44 2.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.193 0.52 . . . . 0.0 109.855 175.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -60.55 -50.07 75.0 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.044 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -139.59 109.07 6.18 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.978 -177.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.783 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.7 mp -70.46 -37.4 74.29 Favored 'General case' 0 C--O 1.221 -0.4 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.424 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.455 ' HA ' HD11 ' A' ' 60' ' ' LEU . 9.6 t70 -53.2 -52.33 59.21 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.591 177.051 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -64.16 -41.55 97.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.276 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.682 ' O ' ' HG3' ' A' ' 142' ' ' LYS . . . -62.99 -50.73 69.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.853 -176.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.833 HD12 HD12 ' A' ' 60' ' ' LEU . 43.1 mt -61.15 -37.03 76.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.377 0.608 . . . . 0.0 110.272 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -61.94 -41.23 97.73 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.278 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.682 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -81.4 -19.51 42.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 111.193 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 75.4 mt -74.29 -39.54 62.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.127 0.489 . . . . 0.0 110.809 176.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.576 HD11 ' HB3' ' A' ' 64' ' ' TYR . 65.4 mt -63.51 -41.79 98.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.423 -177.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.643 ' HG3' ' H ' ' A' ' 146' ' ' GLY . 0.2 OUTLIER -72.11 -82.88 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.525 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.643 ' H ' ' HG3' ' A' ' 145' ' ' GLU . . . 58.83 34.68 78.98 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.255 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -175.81 137.97 0.36 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -133.0 101.61 5.3 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -159.15 17.85 0.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 0.0 110.44 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -170.53 -74.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.177 -176.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -165.6 149.21 8.06 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 52.2 p-80 . . . . . 0 C--O 1.245 0.856 0 CA-C-O 118.608 -0.71 . . . . 0.0 109.644 175.646 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.9 ' HB2' ' HB2' ' A' ' 4' ' ' GLU . 22.9 mmt . . . . . 0 N--CA 1.482 1.151 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.2 m -59.93 -49.0 79.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.775 -177.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 3' ' ' LEU . 3.9 mm? -100.9 25.21 8.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.107 0.48 . . . . 0.0 110.738 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.9 ' HB2' ' HB2' ' A' ' 1' ' ' MET . 20.5 tt0 -83.3 87.85 6.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.471 0.653 . . . . 0.0 109.378 178.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.4 mt -109.91 135.82 20.44 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.508 -174.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HB3' ' HA ' ' A' ' 13' ' ' ALA . 53.4 Cg_exo -57.6 -129.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.525 2.816 . . . . 0.0 113.087 171.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 61.16 30.53 19.39 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.773 0.797 . . . . 0.0 109.156 -176.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -85.43 -164.11 0.96 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.725 -173.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -144.07 25.92 1.54 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.181 179.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.0 mm -116.0 -20.54 5.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.684 0.754 . . . . 0.0 110.726 -177.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HB3' ' OG ' ' A' ' 14' ' ' SER . 57.1 tttm -160.76 -10.46 0.05 OUTLIER 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.588 -175.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 64.41 109.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.484 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.762 ' HB1' ' HG2' ' A' ' 125' ' ' GLU . . . 65.0 49.3 2.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.449 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.44 ' OG ' ' HB3' ' A' ' 11' ' ' LYS . 21.3 m -72.57 95.35 1.81 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.568 0.699 . . . . 0.0 111.316 -179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.847 HG21 ' H ' ' A' ' 126' ' ' LEU . 34.5 pt -99.17 -159.77 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.533 171.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.435 HD12 ' N ' ' A' ' 16' ' ' ILE . 4.0 mp -86.41 89.71 2.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 174.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -69.86 115.43 9.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.694 174.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.502 HD11 ' OH ' ' A' ' 109' ' ' TYR . 7.0 mt -104.26 122.11 56.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.837 -177.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.636 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 2.2 mp0 -112.71 100.5 8.75 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.198 177.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.43 ' HG ' HG22 ' A' ' 18' ' ' ILE . 71.1 mt -132.81 156.19 47.58 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 97.1 mttt -82.3 138.02 34.67 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.886 0.374 . . . . 0.0 111.465 -176.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.605 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.7 p30 -88.96 -167.66 1.95 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.87 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.593 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 55.4 tp -50.39 -36.86 34.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.77 -177.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -77.74 -10.09 59.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.967 0.413 . . . . 0.0 111.805 -178.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.77 18.17 60.37 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -174.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.492 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.9 OUTLIER -100.55 123.57 44.94 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.226 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.631 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 4.7 m -64.48 115.63 5.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.468 0.651 . . . . 0.0 111.367 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.636 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 11.6 mmm180 -88.06 142.67 27.59 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.314 -0.857 . . . . 0.0 108.851 172.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.63 ' CB ' ' HG3' ' A' ' 19' ' ' GLN . 1.5 m -124.01 138.56 54.44 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.543 HD22 HG11 ' A' ' 38' ' ' VAL . 50.5 mt -63.82 -32.92 74.59 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.026 178.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.8 0.05 14.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.258 177.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -105.27 -41.95 5.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.531 0.682 . . . . 0.0 109.339 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.47 ' CD1' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -78.83 -0.16 29.48 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.427 178.19 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.517 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 24.6 ttpp -63.09 102.87 0.41 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.714 176.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.86 -30.49 0.21 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -175.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.556 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -113.63 174.2 6.04 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 167.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.446 HG23 ' HD1' ' A' ' 69' ' ' PHE . 21.3 m -80.93 129.26 37.83 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 173.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.649 ' O ' ' HB ' ' A' ' 120' ' ' VAL . 47.6 t -101.0 116.3 44.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.193 0.52 . . . . 0.0 110.812 -171.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.568 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 14.1 tp -82.84 111.75 19.03 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.622 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 27.4 mm -83.98 105.29 13.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.593 ' HB3' ' HG2' ' A' ' 73' ' ' GLN . 16.2 t70 -108.62 130.08 55.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.791 -178.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.585 ' HB3' HD21 ' A' ' 114' ' ' LEU . 51.5 m-85 -117.69 116.25 26.68 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 173.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.571 ' O ' ' HA ' ' A' ' 75' ' ' SER . 14.7 t -149.36 -176.44 5.38 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 -178.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.654 HG13 ' HB2' ' A' ' 47' ' ' ASN . 1.7 p -131.95 117.89 35.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 176.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.575 ' HD1' ' HB3' ' A' ' 75' ' ' SER . 28.2 m-85 -77.42 79.33 3.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 122.173 0.987 . . . . 0.0 109.329 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.521 ' HB3' HG22 ' A' ' 44' ' ' VAL . 21.3 t-20 178.1 -27.17 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 113.208 -1.815 . . . . 0.0 109.297 -177.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.654 ' HB2' HG13 ' A' ' 44' ' ' VAL . 25.3 t-20 -86.16 141.09 29.61 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.72 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -25.8 66.6 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.163 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 94.5 mmm -68.43 -17.41 64.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.528 -178.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.8 t -71.99 -28.48 63.44 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.64 -55.14 38.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.801 0.334 . . . . 0.0 111.165 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.23 -26.39 63.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.245 0.545 . . . . 0.0 110.831 179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.437 ' NE2' ' OD1' ' A' ' 41' ' ' ASP . 83.6 t60 -70.21 -45.52 66.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.524 -179.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.592 ' HA ' HD12 ' A' ' 57' ' ' LEU . 8.0 m120 -64.31 -28.05 69.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.986 178.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -62.8 -55.09 29.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.609 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.37 74.82 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.592 HD12 ' HA ' ' A' ' 54' ' ' ASN . 90.2 mt -63.56 -41.09 98.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.067 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -61.95 -30.32 70.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.092 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -75.32 -51.86 12.2 Favored 'General case' 0 CA--C 1.493 -1.213 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 -174.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.843 HD12 HD12 ' A' ' 140' ' ' ILE . 2.4 mm? -58.05 -29.99 65.8 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 112.673 -2.058 . . . . 0.0 111.299 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -78.68 -50.35 11.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.028 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -60.6 -21.95 63.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.202 0.525 . . . . 0.0 110.613 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -79.56 -57.1 3.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.412 177.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.671 ' HB3' HD11 ' A' ' 144' ' ' LEU . 91.3 m-85 -112.64 -8.65 13.79 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -165.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.554 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -68.99 169.83 11.0 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.115 -178.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.3 m 70.06 -35.04 0.3 Allowed 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.744 0.652 . . . . 0.0 110.799 -174.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.519 ' H ' ' C ' ' A' ' 65' ' ' ALA . 23.1 mt-30 -82.25 16.88 1.83 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.716 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.96 18.04 14.86 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.994 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.568 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 66.8 t80 -107.61 144.49 34.57 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.556 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 8.7 tp10 -145.06 156.09 43.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.463 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' A' ' 92' ' ' TRP . 48.3 mt -120.26 129.49 75.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.062 0.458 . . . . 0.0 110.001 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.448 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 78.5 t80 -117.8 101.01 7.96 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.405 178.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.593 ' HG2' ' HB3' ' A' ' 41' ' ' ASP . 39.2 mt-30 -92.74 144.15 25.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.473 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 60.5 mt -123.66 116.4 48.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.329 172.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.575 ' HB3' ' HD1' ' A' ' 45' ' ' TYR . 62.7 p -92.11 134.51 34.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.893 0.377 . . . . 0.0 110.993 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.6 HD12 HD22 ' A' ' 114' ' ' LEU . 50.2 mt -104.65 37.35 2.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.311 0.577 . . . . 0.0 109.623 179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.524 ' HA ' HG23 ' A' ' 44' ' ' VAL . 3.5 p30 -87.38 172.05 10.12 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.861 -173.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -125.85 34.36 3.3 Favored Glycine 0 N--CA 1.442 -0.925 0 N-CA-C 110.056 -1.217 . . . . 0.0 110.056 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -149.55 101.92 3.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.17 0.51 . . . . 0.0 109.906 -177.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -76.57 -25.71 54.3 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.654 -174.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -74.34 -30.38 62.0 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.234 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -76.14 -47.62 23.64 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.535 -0.466 . . . . 0.0 109.865 174.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.593 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 59.3 t90 -56.37 -42.02 77.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.632 176.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.539 ' HA ' ' CD1' ' A' ' 23' ' ' LEU . 22.5 ttmm -67.14 -51.78 49.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.315 -179.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 m -69.36 -22.0 63.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 0.0 111.402 -175.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.482 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 22.8 t -85.08 -35.12 22.04 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.262 . . . . 0.0 110.682 178.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.542 ' HA ' HD12 ' A' ' 90' ' ' LEU . . . -79.5 -17.93 53.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.658 -176.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -50.15 -45.74 53.45 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.53 0.519 . . . . 0.0 112.116 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -100.07 14.86 29.24 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.331 -176.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.542 HD12 ' HA ' ' A' ' 87' ' ' ALA . 22.5 mt -88.09 144.73 34.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-O 121.38 0.609 . . . . 0.0 111.923 -176.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.692 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 59.7 Cg_endo -80.89 -38.9 0.24 Allowed 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.828 3.019 . . . . 0.0 113.687 -176.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.692 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.2 p90 -101.17 -169.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.166 -171.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.51 HG11 ' HG3' ' A' ' 28' ' ' ARG . 46.7 t -91.93 131.42 39.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.791 0.329 . . . . 0.0 110.689 -172.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 85.4 m -130.31 114.91 16.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.284 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.605 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 13.4 m -115.97 165.74 10.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -121.92 144.51 48.82 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.349 -179.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -89.17 157.21 18.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.35 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.1 -33.39 29.77 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -174.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.59 ' ND2' ' HB2' ' A' ' 102' ' ' TYR . 53.7 t30 -118.13 -12.21 10.05 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.499 -171.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.9 -128.26 8.5 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.657 175.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.5 4.01 5.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.59 ' HB2' ' ND2' ' A' ' 99' ' ' ASN . 20.7 m-85 -111.69 13.02 21.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.97 0.414 . . . . 0.0 109.949 178.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 31.2 t -64.74 137.43 57.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.443 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 14.8 m -64.36 -24.24 67.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.018 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -61.08 -46.13 91.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.958 178.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.535 HG22 ' CG1' ' A' ' 111' ' ' VAL . 20.9 mt -61.54 -31.23 50.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.075 -174.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 14.3 m -71.18 -23.05 61.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.349 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -82.33 -17.27 46.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.998 -177.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.502 ' OH ' HD11 ' A' ' 18' ' ' ILE . 90.4 m-85 -89.49 -20.59 23.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.198 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 56.47 72.47 0.5 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 122.204 1.002 . . . . 0.0 108.708 -167.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.535 ' CG1' HG22 ' A' ' 106' ' ' ILE . 7.5 p -75.77 136.11 25.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.162 -1.381 . . . . 0.0 110.921 -178.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 4.6 m -78.65 -50.54 11.3 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.315 0.579 . . . . 0.0 109.572 174.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -168.59 139.06 2.49 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.36 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.6 HD22 HD12 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -99.9 154.49 37.21 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 27.4 Cg_endo -62.94 153.28 69.31 Favored 'Cis proline' 0 C--N 1.353 0.776 0 C-N-CA 124.296 -1.127 . . . . 0.0 113.621 0.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.4 m -137.33 170.67 15.69 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.271 -177.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.5 p -142.44 153.69 18.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.622 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 64.1 m-85 -140.85 164.8 29.25 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 177.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 1.016 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 9.9 tp -110.7 134.5 52.4 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -176.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.649 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 10.3 t -125.93 117.25 48.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.421 0.629 . . . . 0.0 110.532 171.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.488 ' HA ' HD13 ' A' ' 143' ' ' LEU . 18.4 t30 -68.9 161.76 28.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.283 177.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -17.66 10.5 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -169.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -90.95 14.79 12.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.005 0.431 . . . . 0.0 110.17 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.517 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 1.0 OUTLIER 59.0 58.96 2.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.025 -175.182 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.762 ' HG2' ' HB1' ' A' ' 13' ' ' ALA . 32.5 mt-10 -124.22 123.77 40.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.054 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.847 ' H ' HG21 ' A' ' 15' ' ' ILE . 19.6 mt -56.52 107.21 0.36 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.417 0.627 . . . . 0.0 110.016 172.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 1.016 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 49.5 m -79.7 -42.47 24.6 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.681 -175.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . 179.96 172.74 1.01 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.392 -179.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.505 ' O ' HG13 ' A' ' 133' ' ' ILE . 86.7 mtm180 -103.59 159.25 15.76 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.909 -178.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -47.23 -43.83 19.43 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 114.327 0.491 . . . . 0.0 114.327 -174.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -72.55 -29.68 63.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.095 0.474 . . . . 0.0 111.379 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.413 ' OD1' ' HB2' ' A' ' 129' ' ' ARG . 8.9 m120 -79.54 -26.44 41.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.829 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.862 HG21 ' HG ' ' A' ' 136' ' ' LEU . 78.3 mt -82.01 112.3 19.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.877 -178.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.449 ' N ' ' HD2' ' A' ' 134' ' ' LYS . 3.3 mptp? -90.44 98.11 11.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.984 174.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.93 106.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.131 -176.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.862 ' HG ' HG21 ' A' ' 133' ' ' ILE . 6.0 mp -70.07 -25.37 63.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.518 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -50.59 -52.64 37.32 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.375 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.52 -44.14 95.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.046 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.472 ' HB1' HD21 ' A' ' 119' ' ' LEU . . . -57.83 -53.88 53.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.698 -176.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.843 HD12 HD12 ' A' ' 60' ' ' LEU . 42.4 mt -60.37 -39.96 82.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.007 0.432 . . . . 0.0 111.115 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 3.9 ttmp? -58.5 -44.36 89.39 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.744 -178.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -78.94 -24.45 43.96 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.769 -176.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 121' ' ' ASN . 27.5 mt -72.18 -38.14 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.24 0.543 . . . . 0.0 110.372 175.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.671 HD11 ' HB3' ' A' ' 64' ' ' TYR . 28.6 mt -61.48 -42.09 98.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.001 -178.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -71.15 -37.05 72.25 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.174 -175.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.431 ' O ' ' HB2' ' A' ' 147' ' ' HIS . . . 53.21 51.51 46.43 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 121.288 -0.482 . . . . 0.0 113.36 174.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . 0.431 ' HB2' ' O ' ' A' ' 146' ' ' GLY . 71.9 m-70 73.69 -60.82 0.52 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 177.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . 0.503 ' O ' ' HB2' ' A' ' 149' ' ' HIS . 79.8 t60 -90.27 -28.36 18.85 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -167.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . 0.503 ' HB2' ' O ' ' A' ' 148' ' ' HIS . 55.9 m-70 71.33 145.55 0.07 Allowed 'General case' 0 N--CA 1.471 0.589 0 O-C-N 123.409 0.443 . . . . 0.0 110.821 -171.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -177.56 -66.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.893 178.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -83.78 -5.01 59.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.358 0.599 . . . . 0.0 109.441 175.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 . . . . . 0 C--O 1.246 0.901 0 CA-C-N 114.706 -1.134 . . . . 0.0 107.976 176.938 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mpp? . . . . . 0 N--CA 1.484 1.241 0 CA-C-O 120.767 0.318 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.2 m -92.92 98.15 11.18 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 176.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 45.1 tp -121.38 118.3 29.09 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.091 -175.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.38 -3.36 40.43 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.547 0.689 . . . . 0.0 110.981 -176.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.5 tt -127.15 122.13 22.96 Favored Pre-proline 0 C--N 1.315 -0.926 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.526 -177.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.519 ' HG2' ' H ' ' A' ' 13' ' ' ALA . 36.7 Cg_endo -64.06 171.69 7.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.038 2.492 . . . . 0.0 113.622 -175.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -117.26 -178.56 3.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.468 -176.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.41 ' OD2' ' HG3' ' A' ' 9' ' ' LYS . 4.9 p-10 -76.81 164.07 26.19 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 171.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.41 ' HG3' ' OD2' ' A' ' 8' ' ' ASP . 54.5 mttp 71.6 8.34 6.17 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.894 0.855 . . . . 0.0 109.453 -172.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.578 HG22 ' H ' ' A' ' 11' ' ' LYS . 2.5 mt -137.21 178.93 4.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 114.323 -1.308 . . . . 0.0 107.5 176.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.578 ' H ' HG22 ' A' ' 10' ' ' ILE . 4.2 mptp? -83.45 92.54 7.6 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.52 0.676 . . . . 0.0 109.492 176.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -80.12 139.82 36.69 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.531 -174.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.519 ' H ' ' HG2' ' A' ' 6' ' ' PRO . . . 61.83 25.57 15.39 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.436 173.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.4 p -83.77 -27.5 28.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.209 0.528 . . . . 0.0 109.988 175.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.699 HG21 ' O ' ' A' ' 124' ' ' ASN . 6.9 tt -171.07 147.49 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.254 179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.502 ' O ' HD12 ' A' ' 30' ' ' LEU . 3.9 mp -97.26 138.01 23.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 176.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -92.64 108.48 20.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.558 HD11 ' OH ' ' A' ' 109' ' ' TYR . 8.9 mt -89.47 115.4 29.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.352 -177.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -111.91 100.16 8.68 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.517 -177.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.704 ' HB2' HG11 ' A' ' 95' ' ' VAL . 22.2 mt -136.08 162.42 32.96 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.636 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.1 mttm -90.83 147.47 23.16 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.67 0.747 . . . . 0.0 111.17 178.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.59 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.7 OUTLIER -84.27 -173.51 4.76 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.307 -1.315 . . . . 0.0 110.625 -174.036 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.86 HD11 ' HA ' ' A' ' 84' ' ' LYS . 15.0 tp -54.29 -42.73 70.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.616 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.509 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -68.02 -39.92 83.04 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.601 178.314 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.471 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 124.12 13.91 3.87 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.172 -178.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.8 m-80 -96.7 125.44 41.16 Favored 'General case' 0 C--N 1.323 -0.565 0 O-C-N 122.818 -0.225 . . . . 0.0 110.536 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.636 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 7.8 m -63.33 113.6 3.32 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.407 0.622 . . . . 0.0 110.586 177.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.514 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 9.4 mmm180 -102.16 127.97 48.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.246 177.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 57.6 p -115.67 158.42 22.77 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 174.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.815 ' HB3' HD21 ' A' ' 124' ' ' ASN . 79.0 mt -74.07 -29.12 61.72 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.4 p -63.37 -22.6 66.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.569 175.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -91.13 -34.42 15.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.602 0.715 . . . . 0.0 109.724 179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.681 HD11 ' HG2' ' A' ' 70' ' ' GLU . 11.9 tp -82.01 10.04 7.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.857 -177.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -64.18 -11.17 28.25 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.591 -178.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.36 -18.46 65.38 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.1 -178.31 4.77 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 120.891 0.377 . . . . 0.0 110.266 177.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.674 HG23 ' HD1' ' A' ' 69' ' ' PHE . 16.6 m -85.36 126.83 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.707 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 168.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.529 HG11 HD22 ' A' ' 30' ' ' LEU . 38.7 t -101.04 129.18 52.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.27 0.557 . . . . 0.0 111.663 -167.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.761 HD11 HD21 ' A' ' 136' ' ' LEU . 12.4 tp -95.72 110.58 22.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.512 173.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.557 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.0 mm -84.77 105.78 14.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.5 ' HB3' ' NE2' ' A' ' 73' ' ' GLN . 5.6 t70 -114.04 129.82 56.59 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.898 -175.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -116.58 97.78 6.19 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.76 ' O ' ' HA ' ' A' ' 75' ' ' SER . 15.5 m -137.95 141.45 40.54 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.212 0.53 . . . . 0.0 111.518 -170.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.66 HG13 ' HB2' ' A' ' 47' ' ' ASN . 0.1 OUTLIER -95.63 118.22 41.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.018 -177.799 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -77.26 80.74 3.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.662 0.744 . . . . 0.0 109.708 174.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.479 ' HB3' ' CG2' ' A' ' 44' ' ' VAL . 19.7 t-20 174.35 -33.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.855 -176.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.66 ' HB2' HG13 ' A' ' 44' ' ' VAL . 8.0 t-20 -73.4 148.85 42.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.529 -1.214 . . . . 0.0 111.031 -176.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.43 -33.54 71.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.807 -178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.1 tpp -67.58 -26.79 66.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.936 0.398 . . . . 0.0 111.061 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 14.7 m -60.99 -32.97 72.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.997 -175.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.69 95.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.842 0.353 . . . . 0.0 111.191 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.66 -29.49 45.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.098 0.475 . . . . 0.0 110.572 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.445 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 85.5 t60 -65.85 -42.41 90.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.819 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.401 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.5 m-20 -66.23 -21.44 66.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.591 -179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.451 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.2 tm? -64.14 -54.92 26.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.416 0.627 . . . . 0.0 109.91 176.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.18 -33.11 72.92 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.8 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 86.8 mt -65.15 -40.45 94.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.804 176.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.451 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 8.1 tpt180 -59.28 -33.51 71.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.778 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.81 -55.1 6.18 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -172.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.81 HD12 HD12 ' A' ' 140' ' ' ILE . 2.0 mm? -55.2 -31.91 61.8 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 112.846 -1.979 . . . . 0.0 111.624 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.404 ' HD1' HG13 ' A' ' 71' ' ' ILE . 24.9 t80 -77.97 -48.8 15.42 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.299 -0.409 . . . . 0.0 109.978 -178.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.406 ' N ' HD22 ' A' ' 62' ' ' ASN . 1.0 OUTLIER -63.79 -21.68 66.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.548 -177.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -77.36 -58.62 3.17 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.91 177.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.623 ' CE1' ' HG3' ' A' ' 141' ' ' LYS . 96.2 m-85 -109.14 -10.65 14.98 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 -165.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -53.65 -37.87 63.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.219 0.463 . . . . 0.0 111.849 -176.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.4 m -67.64 -15.21 63.53 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.783 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -107.99 9.61 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 0.0 111.054 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.439 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 104.88 48.97 1.04 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.912 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.674 ' HD1' HG23 ' A' ' 37' ' ' VAL . 72.4 t80 -121.92 138.77 54.28 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.105 -0.331 . . . . 0.0 110.105 178.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.681 ' HG2' HD11 ' A' ' 33' ' ' LEU . 8.7 tp10 -138.69 146.03 41.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.287 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.422 HD12 ' CE3' ' A' ' 92' ' ' TRP . 72.2 mt -112.41 124.64 69.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.927 0.394 . . . . 0.0 110.239 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.595 ' CE1' HG21 ' A' ' 95' ' ' VAL . 89.9 t80 -104.5 100.0 9.68 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.824 HE21 ' HA ' ' A' ' 73' ' ' GLN . 0.0 OUTLIER -83.49 136.67 34.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.861 -177.691 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -125.78 108.32 19.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.76 ' HA ' ' O ' ' A' ' 43' ' ' THR . 66.5 p -83.11 126.3 32.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.309 0.576 . . . . 0.0 111.189 -175.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.519 HD22 ' H ' ' A' ' 101' ' ' ALA . 17.3 mt -102.94 39.36 1.56 Allowed 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.594 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.8 p-10 -61.42 -71.91 0.13 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.433 -1.258 . . . . 0.0 113.266 -170.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.41 12.25 42.3 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -170.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -163.1 100.47 0.97 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.9 -26.37 61.4 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.008 -171.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -74.02 -29.1 61.76 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.694 -0.803 . . . . 0.0 110.89 -174.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -71.68 -48.9 44.38 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.579 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 27.9 t90 -60.67 -47.19 87.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.293 177.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.86 ' HA ' HD11 ' A' ' 23' ' ' LEU . 12.2 ttmt -62.35 -45.33 93.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.639 0.257 . . . . 0.0 111.497 -174.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -68.12 -31.23 70.68 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.461 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 25.4 p -85.58 -33.67 21.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.897 0.38 . . . . 0.0 111.651 -177.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.522 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -86.32 -18.92 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.604 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 15.1 t70 -64.12 -27.05 68.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.899 0.381 . . . . 0.0 111.789 -173.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -97.0 8.23 44.93 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.282 0.563 . . . . 0.0 110.419 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.3 mt -86.89 152.21 53.32 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.179 0.514 . . . . 0.0 111.726 -177.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.594 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 80.2 Cg_endo -72.53 -58.67 0.07 OUTLIER 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.691 2.928 . . . . 0.0 114.046 -176.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.594 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 9.9 p90 -83.35 -173.79 4.91 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -170.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 37.4 t -74.98 124.63 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.109 -173.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 m -117.94 109.47 16.54 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 -178.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.704 HG11 ' HB2' ' A' ' 20' ' ' LEU . 11.3 t -115.99 156.56 17.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.814 -176.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.427 ' HB2' ' CH2' ' A' ' 83' ' ' TRP . 14.8 ttp180 -113.21 139.62 48.63 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.487 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.67 156.99 20.44 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 120.955 0.407 . . . . 0.0 110.065 175.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.453 ' C ' HD22 ' A' ' 99' ' ' ASN . . . -82.04 -29.17 32.07 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -175.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.453 HD22 ' C ' ' A' ' 98' ' ' ALA . 0.9 OUTLIER -114.26 -14.1 12.3 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -171.811 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.405 ' O ' ' HB3' ' A' ' 101' ' ' ALA . . . 67.56 78.03 0.3 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.486 178.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.519 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 80.42 -31.53 0.12 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.878 0.871 . . . . 0.0 111.897 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -85.01 37.34 0.66 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.344 0.593 . . . . 0.0 110.016 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.547 ' HB3' HG13 ' A' ' 106' ' ' ILE . 22.8 t -89.7 141.95 28.13 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.126 -172.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.438 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 2.9 p -61.28 -38.22 85.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.178 178.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -55.35 -44.48 75.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.377 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.547 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.5 mt -64.27 -28.94 46.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.011 -176.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 27.9 m -77.8 -24.76 48.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.582 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 104' ' ' SER . 91.9 mt -71.18 -37.23 72.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.993 -179.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.558 ' OH ' HD11 ' A' ' 18' ' ' ILE . 93.3 m-85 -69.87 -23.14 63.22 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.292 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 59.49 69.01 0.74 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.384 1.088 . . . . 0.0 108.801 -167.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.584 HG11 HD21 ' A' ' 114' ' ' LEU . 13.1 p -79.16 153.24 4.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 113.855 -1.52 . . . . 0.0 111.045 -177.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.445 ' HB ' ' HG2' ' A' ' 131' ' ' GLU . 1.7 m -102.94 -31.16 10.37 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.428 177.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -157.18 124.17 5.13 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -175.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.642 HD13 ' OG ' ' A' ' 116' ' ' SER . 3.0 mm? -98.75 143.47 26.41 Favored Pre-proline 0 N--CA 1.469 0.486 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 170.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.429 ' C ' ' HA ' ' A' ' 114' ' ' LEU . 24.1 Cg_exo -65.26 152.52 77.46 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 124.474 -1.052 . . . . 0.0 112.655 0.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.642 ' OG ' HD13 ' A' ' 114' ' ' LEU . 13.0 m -127.55 166.12 18.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.036 -175.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 40' ' ' ILE . 7.9 p -143.28 154.56 16.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.557 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 84.4 m-85 -139.02 163.74 31.6 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 176.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.897 HD13 HD11 ' A' ' 136' ' ' LEU . 14.7 tp -110.53 135.43 51.2 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.523 ' HB ' ' O ' ' A' ' 38' ' ' VAL . 44.9 t -133.62 125.08 49.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.754 0.312 . . . . 0.0 110.484 176.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.577 ' HB3' HD22 ' A' ' 143' ' ' LEU . 8.9 p30 -82.9 166.75 18.65 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -75.31 18.62 0.2 Allowed 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -169.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.467 ' HB3' ' HG3' ' A' ' 125' ' ' GLU . 63.4 t30 -95.22 -0.86 52.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 166.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.815 HD21 ' HB3' ' A' ' 30' ' ' LEU . 2.4 t-20 59.78 67.21 0.9 Allowed 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.561 -165.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 3.1 mm-40 -137.83 141.76 40.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.326 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 47.8 mt -68.88 130.79 43.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.536 0.684 . . . . 0.0 110.729 177.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.84 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 73.2 m -101.63 -49.87 3.88 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.942 -177.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -164.86 164.5 20.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.859 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.418 ' O ' HG13 ' A' ' 133' ' ' ILE . 92.8 mtt180 -96.96 162.24 13.48 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.21 -36.37 92.3 Favored Glycine 0 C--O 1.226 -0.374 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.242 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.445 ' HG2' ' HB ' ' A' ' 112' ' ' THR . 2.7 mp0 -76.46 -1.87 29.28 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.98 0.419 . . . . 0.0 110.736 179.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -112.49 -18.13 12.49 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 110.539 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.703 HD13 HD13 ' A' ' 136' ' ' LEU . 96.7 mt -88.82 110.13 20.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.3 0.572 . . . . 0.0 111.247 -175.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.656 ' HG3' ' H ' ' A' ' 135' ' ' ASP . 11.2 ptmm? -72.94 -60.07 2.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 174.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.656 ' H ' ' HG3' ' A' ' 134' ' ' LYS . 7.2 m-20 -128.06 116.67 20.35 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.897 HD11 HD13 ' A' ' 119' ' ' LEU . 2.9 tp -75.28 -27.25 59.31 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.293 0.568 . . . . 0.0 109.553 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -52.55 -56.29 16.28 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.608 178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.416 ' HG2' ' HB2' ' A' ' 135' ' ' ASP . 12.1 pt-20 -62.46 -48.65 78.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.033 0.444 . . . . 0.0 111.33 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 138' ' ' GLU . . . -55.95 -54.25 46.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.292 -0.867 . . . . 0.0 112.286 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.81 HD12 HD12 ' A' ' 60' ' ' LEU . 27.0 mt -63.5 -29.68 47.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.727 0.299 . . . . 0.0 111.247 -176.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.623 ' HG3' ' CE1' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -61.8 -43.81 98.11 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 110.018 177.508 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 59.5 mmtt -75.27 -19.2 59.84 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.014 -178.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.577 HD22 ' HB3' ' A' ' 121' ' ' ASN . 40.2 mt -71.82 -40.25 69.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.289 0.566 . . . . 0.0 110.506 175.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.495 HD11 ' HB3' ' A' ' 64' ' ' TYR . 95.4 mt -71.77 -43.29 65.99 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.56 -177.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 146' ' ' GLY . 12.4 pt-20 -80.98 -50.77 9.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.769 178.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.417 ' N ' ' HG3' ' A' ' 145' ' ' GLU . . . 62.89 -133.68 43.65 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.446 -0.407 . . . . 0.0 112.387 -178.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -159.67 64.83 0.37 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.796 0.807 . . . . 0.0 109.928 174.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -145.25 21.7 1.54 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.548 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 150' ' ' HIS . 69.9 m80 -118.0 11.89 13.52 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.869 178.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.428 ' HB2' ' O ' ' A' ' 149' ' ' HIS . 37.6 m80 72.9 -60.83 0.52 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.039 -178.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -79.85 -23.78 41.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.308 0.575 . . . . 0.0 109.525 173.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 . . . . . 0 C--O 1.245 0.816 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 169.766 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.6 ttt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.96 0.409 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 p -83.11 -65.01 1.06 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.845 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.6 tp -116.14 114.16 24.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.82 -178.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -99.93 134.18 43.22 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.048 177.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 44.8 mm -124.28 90.06 51.24 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 120.734 0.302 . . . . 0.0 111.2 -178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -82.45 164.14 16.75 Favored 'Trans proline' 0 CA--C 1.512 -0.577 0 C-N-CA 122.584 2.19 . . . . 0.0 112.138 171.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -163.27 149.98 12.39 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.077 -168.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -163.04 94.46 0.83 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.044 -179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.544 ' HG2' HG13 ' A' ' 10' ' ' ILE . 4.7 ttpm? 67.36 -79.02 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.982 0.801 . . . . 0.0 112.848 169.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.544 HG13 ' HG2' ' A' ' 9' ' ' LYS . 9.7 mt -111.72 46.24 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.44 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.421 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 12.6 ttpp 57.83 36.14 26.1 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.773 0.797 . . . . 0.0 109.947 179.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -84.2 -27.77 27.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.664 -171.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.19 -7.47 42.14 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.206 -176.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.2 m -67.58 101.63 1.04 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.489 0.661 . . . . 0.0 109.935 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.576 HG21 ' O ' ' A' ' 124' ' ' ASN . 13.5 tt -65.85 143.25 15.85 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.762 -177.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.453 HG12 HD13 ' A' ' 108' ' ' LEU . 4.4 mp -99.31 130.65 47.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.486 175.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -75.85 107.51 8.08 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 176.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.505 HD11 ' OH ' ' A' ' 109' ' ' TYR . 9.2 mt -89.02 105.37 15.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.686 -172.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.674 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 76.8 mt-30 -100.12 99.95 10.73 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.522 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.8 mt -136.82 153.11 50.89 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 176.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.68 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 90.8 mttt -87.87 136.23 33.05 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.907 0.86 . . . . 0.0 112.103 -173.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.08 165.85 3.99 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.5 -1.682 . . . . 0.0 108.952 172.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.531 ' HA ' ' CH2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER -59.43 -30.05 68.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.642 0.734 . . . . 0.0 110.143 179.083 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.521 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 36.3 mtmm -69.05 -8.54 46.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.13 176.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.39 8.06 61.49 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.406 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -97.23 111.98 23.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.7 0.286 . . . . 0.0 111.538 -176.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.68 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 52.7 m -57.93 118.47 5.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.329 0.585 . . . . 0.0 111.225 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.674 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 24.3 mmt180 -93.51 143.87 25.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.648 176.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.1 p -122.79 150.82 42.3 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 170.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.659 ' HB3' HD21 ' A' ' 124' ' ' ASN . 31.4 mt -71.03 -29.9 65.96 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.051 0.453 . . . . 0.0 109.974 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 p -61.86 -19.42 62.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.425 175.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -87.25 -38.34 16.41 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.724 0.773 . . . . 0.0 109.848 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.643 HD23 HG13 ' A' ' 38' ' ' VAL . 11.5 tp -78.55 -1.51 34.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.884 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.561 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 36.1 ttpt -64.77 -10.59 28.83 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.476 0.655 . . . . 0.0 111.068 179.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -65.11 -15.27 60.45 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.917 -0.658 . . . . 0.0 111.734 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -132.2 -179.23 5.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.476 0.655 . . . . 0.0 110.416 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.495 HG22 ' HB3' ' A' ' 122' ' ' ARG . 99.7 t -84.8 128.9 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 170.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.643 HG13 HD23 ' A' ' 33' ' ' LEU . 43.6 t -106.57 122.77 60.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.292 0.568 . . . . 0.0 112.396 -162.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.671 HD11 HD21 ' A' ' 136' ' ' LEU . 13.3 tp -95.08 116.94 29.36 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.93 172.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.627 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 20.7 mm -91.4 106.34 17.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 178.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.551 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 9.0 t70 -107.53 141.38 39.06 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.73 0.3 . . . . 0.0 111.101 -178.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -128.46 111.84 13.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.699 174.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 t -154.84 175.09 14.18 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.937 0.399 . . . . 0.0 111.006 179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.661 HG23 ' HB2' ' A' ' 47' ' ' ASN . 7.9 m -112.98 121.68 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.923 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -75.99 83.83 2.88 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 173.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 179.98 -39.38 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.684 -167.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.661 ' HB2' HG23 ' A' ' 44' ' ' VAL . 2.1 t-20 -88.5 149.61 23.54 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.31 -1.314 . . . . 0.0 111.387 -168.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.01 -29.97 69.1 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.67 176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.7 -25.55 64.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.555 -179.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 m -67.85 -27.49 66.74 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.14 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.22 -54.59 38.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.688 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.63 -38.03 86.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.171 0.51 . . . . 0.0 110.568 178.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.43 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 84.4 t60 -61.6 -40.91 96.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.711 179.018 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.587 ' HA ' HD12 ' A' ' 57' ' ' LEU . 18.2 t-20 -71.33 -34.72 70.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.749 -178.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.5 tt -65.58 -41.76 92.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.37 -38.29 80.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.328 0.585 . . . . 0.0 110.205 176.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 ' HA ' ' A' ' 54' ' ' ASN . 58.8 mt -67.34 -39.67 85.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.663 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.47 ' HD2' ' OD1' ' A' ' 62' ' ' ASN . 3.3 tpp180 -61.31 -24.96 66.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.289 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -74.46 -56.11 5.22 Favored 'General case' 0 CA--C 1.488 -1.436 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.604 HD11 ' HA ' ' A' ' 137' ' ' ASP . 2.1 mm? -56.19 -29.14 60.49 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-N 111.749 -2.478 . . . . 0.0 111.11 177.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.409 ' CE2' ' HB2' ' A' ' 91' ' ' PRO . 37.6 t80 -76.38 -52.95 8.87 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.439 -178.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.47 ' OD1' ' HD2' ' A' ' 58' ' ' ARG . 5.9 m-20 -62.48 -22.38 66.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.171 0.51 . . . . 0.0 110.369 -178.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -81.19 -62.05 1.77 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.832 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.614 ' HB3' ' CD1' ' A' ' 144' ' ' LEU . 87.9 m-85 -107.76 -8.08 16.16 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 -163.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.524 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.48 -16.89 64.46 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.706 -0.621 . . . . 0.0 111.428 -177.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.8 m -85.56 5.6 30.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.525 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -118.41 14.83 13.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.214 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.17 43.01 3.88 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.832 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.524 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 83.3 t80 -127.91 138.81 52.79 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -177.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -145.24 141.59 28.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 0.0 109.847 178.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.476 HD12 ' CE3' ' A' ' 92' ' ' TRP . 56.3 mt -99.06 132.79 43.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.941 -174.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.515 ' HB2' ' CD2' ' A' ' 33' ' ' LEU . 90.1 t80 -111.02 101.43 9.99 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.067 177.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.551 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 6.1 tt0 -102.72 119.11 38.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.15 0.5 . . . . 0.0 111.399 -173.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.466 HD11 HG21 ' A' ' 18' ' ' ILE . 69.9 mt -96.69 127.93 48.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.777 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.0 m -100.37 129.63 46.37 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.401 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.513 HD13 HD12 ' A' ' 114' ' ' LEU . 0.7 OUTLIER -123.86 22.28 8.93 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.075 0.464 . . . . 0.0 110.461 177.569 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.536 ' HB3' ' HB ' ' A' ' 44' ' ' VAL . 4.6 p-10 -79.09 178.68 7.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.085 -178.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.09 30.84 5.7 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.608 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -135.64 102.49 5.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.443 0.639 . . . . 0.0 111.028 177.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.451 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 28.5 tt0 -69.81 -18.33 63.46 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.876 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -70.09 -59.5 2.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.931 -176.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -66.32 -36.06 81.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.502 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.531 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 33.2 t90 -57.56 -60.05 4.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.866 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.451 ' HE3' ' HG2' ' A' ' 80' ' ' GLU . 31.6 ttmt -61.17 -44.19 97.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.144 -174.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.3 m -62.41 -49.13 76.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.439 -178.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.636 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.1 t -70.82 -45.94 63.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.618 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.457 ' HB1' HD22 ' A' ' 23' ' ' LEU . . . -58.85 -40.58 84.67 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -175.298 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.33 -28.84 70.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.294 0.569 . . . . 0.0 110.611 179.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -96.99 7.26 47.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.306 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 86' ' ' SER . 32.3 mt -100.01 153.59 37.68 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-O 121.177 0.513 . . . . 0.0 111.837 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.637 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 85.6 Cg_endo -75.17 -45.32 0.28 Allowed 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 123.958 3.106 . . . . 0.0 114.005 -176.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.637 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 6.0 p90 -94.96 -171.04 2.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.029 0.443 . . . . 0.0 112.021 -171.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.2 t -80.05 124.83 38.57 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.668 -174.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 39.1 m -123.44 109.4 13.8 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.379 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 18.6 m -122.31 161.51 23.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.885 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.423 HH12 ' HB2' ' A' ' 80' ' ' GLU . 59.4 ttp180 -124.47 144.21 50.21 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.054 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.97 163.44 24.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.125 178.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.0 -32.82 30.39 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 -177.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.564 ' HB3' ' HB2' ' A' ' 102' ' ' TYR . 64.9 m-20 -113.75 -12.41 12.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.691 0.281 . . . . 0.0 111.488 -172.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 72.83 -116.3 5.58 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.207 179.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.29 -14.34 62.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.064 0.459 . . . . 0.0 111.118 178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.564 ' HB2' ' HB3' ' A' ' 99' ' ' ASN . 97.8 m-85 -96.5 19.64 11.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.369 177.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.459 ' HB3' HG13 ' A' ' 106' ' ' ILE . 45.4 t -66.79 138.99 57.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.016 -178.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.583 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.9 m -67.61 -25.84 65.95 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.281 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.52 ' HA ' HD12 ' A' ' 108' ' ' LEU . 98.0 m-85 -61.7 -42.3 98.76 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.203 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.459 HG13 ' HB3' ' A' ' 103' ' ' SER . 67.5 mt -59.94 -32.72 50.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.841 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.2 m -76.81 -33.3 57.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.852 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 104' ' ' SER . 95.9 mt -62.92 -39.5 94.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.735 -178.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.505 ' OH ' HD11 ' A' ' 18' ' ' ILE . 68.3 m-85 -81.57 -19.42 42.04 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.438 178.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.5 t30 63.54 75.32 0.39 Allowed 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -166.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.454 ' HB ' HG23 ' A' ' 106' ' ' ILE . 25.1 t -98.85 132.89 43.26 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.31 -177.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 3.7 m -74.93 -44.51 48.23 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.344 179.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -170.57 133.1 0.99 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.726 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.705 ' HB3' ' HA ' ' A' ' 115' ' ' PRO . 80.0 mt -85.63 170.15 13.85 Favored Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 171.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.705 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 10.9 Cg_exo -70.96 153.94 96.23 Favored 'Cis proline' 0 C--N 1.355 0.891 0 CA-C-N 120.005 1.037 . . . . 0.0 113.202 0.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 69.1 m -145.13 172.91 12.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.481 -177.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.574 HG12 ' HA3' ' A' ' 130' ' ' GLY . 2.7 p -142.31 158.75 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.627 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 95.3 m-85 -140.96 161.95 36.63 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 176.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.804 HD13 HD11 ' A' ' 136' ' ' LEU . 17.0 tp -111.05 134.56 52.55 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.175 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.579 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 16.8 t -131.1 119.07 43.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.886 0.374 . . . . 0.0 110.182 175.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.598 ' ND2' ' HB2' ' A' ' 125' ' ' GLU . 3.5 p30 -74.69 164.44 26.58 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.495 ' HB3' HG22 ' A' ' 37' ' ' VAL . 18.0 ptt180 -52.56 -19.19 2.12 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 124.429 1.081 . . . . 0.0 113.795 -171.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -84.3 11.49 8.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.068 0.461 . . . . 0.0 109.907 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.659 HD21 ' HB3' ' A' ' 30' ' ' LEU . 1.8 t-20 57.79 55.35 5.5 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.161 -176.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.598 ' HB2' ' ND2' ' A' ' 121' ' ' ASN . 31.7 mt-10 -129.06 146.74 50.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.554 178.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 35.3 mt -72.61 112.09 8.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.171 0.51 . . . . 0.0 111.029 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.641 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 9.9 m -74.3 -56.87 4.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.527 177.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -166.94 170.93 11.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.909 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.567 ' HD2' ' HE2' ' A' ' 118' ' ' PHE . 14.7 mmt180 -82.89 152.67 25.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.574 ' HA3' HG12 ' A' ' 117' ' ' VAL . . . -62.28 -34.04 87.97 Favored Glycine 0 CA--C 1.509 -0.337 0 N-CA-C 111.712 -0.555 . . . . 0.0 111.712 177.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 131' ' ' GLU . 17.8 mp0 -64.35 -28.68 69.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.682 -0.759 . . . . 0.0 110.21 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -99.47 -6.32 27.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.961 -1.018 . . . . 0.0 110.752 -171.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 129' ' ' ARG . 85.0 mt -102.76 108.52 24.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.182 -179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.409 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 18.5 pttp -64.17 -48.56 75.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.942 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.409 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 7.3 m-20 -127.77 107.38 9.84 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.804 HD11 HD13 ' A' ' 119' ' ' LEU . 7.3 tp -74.92 -34.6 62.14 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -178.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.604 ' HA ' HD11 ' A' ' 60' ' ' LEU . 11.5 t70 -46.93 -58.2 4.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.682 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -62.72 -45.37 93.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.562 -179.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.515 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -55.7 -52.24 64.57 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.695 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.661 HG13 ' O ' ' A' ' 136' ' ' LEU . 52.5 mt -57.82 -45.83 87.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 0.0 110.395 177.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 66.7 tttm -52.69 -46.52 67.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.934 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.705 ' HA ' ' HG2' ' A' ' 145' ' ' GLU . 34.3 mttm -71.5 -29.37 64.73 Favored 'General case' 0 N--CA 1.435 -1.198 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 81.4 mt -65.22 -41.72 94.13 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.787 0.803 . . . . 0.0 109.484 173.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.614 ' CD1' ' HB3' ' A' ' 64' ' ' TYR . 70.8 mt -72.58 -52.2 16.5 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.879 -178.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.705 ' HG2' ' HA ' ' A' ' 142' ' ' LYS . 24.1 pt-20 -69.28 -10.19 56.69 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.909 -172.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -72.49 26.6 0.72 Allowed Glycine 0 CA--C 1.523 0.545 0 C-N-CA 120.893 -0.67 . . . . 0.0 113.137 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . 0.435 ' H ' ' C ' ' A' ' 145' ' ' GLU . 31.5 t-80 -121.85 -0.85 9.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.452 0.644 . . . . 0.0 109.575 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . 0.689 ' HB3' ' O ' ' A' ' 152' ' ' HIS . 26.0 t60 -162.3 173.77 13.73 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 -177.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 12.7 p-80 -154.22 80.78 1.12 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 119.893 1.224 . . . . 0.0 113.456 178.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 54.4 m-70 -151.88 -70.96 0.16 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.904 171.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 48.5 t-80 -118.6 -37.08 3.35 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . 0.689 ' O ' ' HB3' ' A' ' 148' ' ' HIS . 35.3 t60 . . . . . 0 C--O 1.24 0.576 0 CA-C-N 114.232 -1.349 . . . . 0.0 108.518 175.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.402 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.482 1.142 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 m -54.59 -42.58 71.26 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 171.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -90.58 127.34 36.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.751 164.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -141.14 137.48 32.78 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.905 0.383 . . . . 0.0 110.4 -177.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 44.2 mm -118.33 112.12 37.85 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.175 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -59.75 115.75 2.83 Favored 'Trans proline' 0 CA--C 1.517 -0.374 0 C-N-CA 123.248 2.632 . . . . 0.0 114.06 176.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.01 -89.88 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.172 -1.376 . . . . 0.0 111.424 173.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -88.02 47.37 1.49 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.149 0.5 . . . . 0.0 111.178 -176.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -138.57 -164.86 1.71 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.047 -177.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 19.3 mm -71.42 4.79 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 122.126 0.965 . . . . 0.0 111.007 -176.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -157.13 128.61 6.95 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.522 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -100.82 -161.05 0.83 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 175.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.23 68.44 0.5 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.065 0.46 . . . . 0.0 112.229 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 97.8 p -104.41 -17.8 14.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.449 0.642 . . . . 0.0 109.52 174.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.565 HD12 ' O ' ' A' ' 124' ' ' ASN . 2.4 tt -158.69 141.11 5.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.869 176.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.7 mp -107.05 114.08 45.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 171.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.47 108.46 14.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.119 0.485 . . . . 0.0 109.953 -176.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 29' ' ' SER . 7.0 mt -94.93 124.9 47.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.612 -178.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -120.97 99.21 6.37 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.546 -177.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.468 ' HB2' ' CG2' ' A' ' 95' ' ' VAL . 43.3 mt -131.09 159.1 38.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 63.9 mttp -90.19 142.57 27.58 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.04 0.448 . . . . 0.0 111.904 -178.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.58 ' OD1' ' HG2' ' A' ' 24' ' ' LYS . 15.9 t70 -75.88 176.89 7.41 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.092 179.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.92 HD11 ' HB3' ' A' ' 87' ' ' ALA . 3.0 mm? -46.81 -39.77 12.49 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 123.608 0.763 . . . . 0.0 110.889 177.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.58 ' HG2' ' OD1' ' A' ' 22' ' ' ASP . 30.6 mmtm -60.08 -48.92 79.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.954 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 127.47 9.62 3.97 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.831 -0.907 . . . . 0.0 110.831 -176.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.438 ' OD1' ' HB3' ' A' ' 22' ' ' ASP . 2.2 p30 -103.5 130.72 50.93 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.826 -0.687 . . . . 0.0 110.8 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.602 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 42.2 m -70.08 128.95 38.07 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.206 0.527 . . . . 0.0 111.313 -178.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.546 ' HG3' ' CG1' ' A' ' 93' ' ' VAL . 15.3 mmm180 -112.18 132.99 54.58 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.984 175.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 18' ' ' ILE . 63.7 p -121.53 163.49 18.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.785 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.474 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 73.6 mt -76.11 -28.78 57.63 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 177.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.4 p -67.14 -14.58 63.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.371 175.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.02 -32.01 19.02 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.533 ' HB3' HG21 ' A' ' 38' ' ' VAL . 4.0 mp -90.71 10.04 27.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.905 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.665 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.4 ttmm -72.86 128.25 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.137 0.494 . . . . 0.0 110.372 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.07 -20.38 9.17 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 -172.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -109.22 168.71 9.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.922 -0.639 . . . . 0.0 110.376 177.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.833 HG23 ' HD2' ' A' ' 122' ' ' ARG . 80.6 t -91.34 118.58 36.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 169.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.732 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 95.2 t -111.5 131.38 62.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 121.716 0.769 . . . . 0.0 112.129 -169.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.9 tt -92.27 110.0 21.39 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.159 174.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.648 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 3.0 mp -84.19 106.49 14.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 175.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.624 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 26.1 t0 -98.55 144.74 27.54 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.601 178.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.539 ' HB3' HD21 ' A' ' 114' ' ' LEU . 21.7 m-85 -133.41 105.85 7.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 175.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.9 t -154.18 155.82 35.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.148 -174.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.511 HG13 HD23 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -96.79 118.89 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.139 172.721 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.402 ' HD1' ' OG ' ' A' ' 75' ' ' SER . 17.7 m-85 -66.71 87.77 0.13 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 170.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 177.82 -35.51 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.102 -1.408 . . . . 0.0 109.157 -168.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -89.01 142.3 27.76 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.207 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.42 -29.81 64.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.961 -175.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 95.4 mmm -64.32 -20.13 65.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.602 0.239 . . . . 0.0 111.337 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.4 t -64.99 -27.16 68.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.31 -50.17 61.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.388 . . . . 0.0 110.598 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.36 -29.41 69.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.418 0.627 . . . . 0.0 110.314 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.564 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 62.5 t60 -68.08 -47.38 68.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.5 176.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.577 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.2 m-20 -65.37 -27.14 68.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.985 178.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -60.76 -53.68 54.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.407 0.622 . . . . 0.0 109.886 174.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.67 -33.95 74.89 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.662 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 54' ' ' ASN . 93.2 mt -63.92 -39.57 94.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.882 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -64.23 -26.04 68.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.728 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 5.1 tt0 -78.02 -50.46 12.06 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -177.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 63' ' ' LYS . 19.0 mt -53.72 -34.47 58.97 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 112.448 -2.16 . . . . 0.0 111.179 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.462 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 35.5 t80 -67.67 -45.76 74.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.275 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -68.04 -21.28 65.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.998 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.561 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 60.7 mttm -85.49 -61.15 1.83 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.679 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.583 ' HB3' HD11 ' A' ' 144' ' ' LEU . 66.8 m-85 -106.27 -14.8 15.01 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -163.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.548 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.35 169.7 11.78 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.92 -177.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 24.7 m 72.82 -35.7 0.33 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.386 0.675 . . . . 0.0 111.46 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 65' ' ' ALA . 47.6 mt-30 -81.87 11.03 5.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 110.944 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.4 47.53 1.3 Allowed Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.669 -176.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.548 ' HB3' ' HA ' ' A' ' 65' ' ' ALA . 64.5 t80 -141.43 134.65 29.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 178.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -143.55 150.05 38.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.499 HD12 ' CE3' ' A' ' 92' ' ' TRP . 58.5 mt -110.36 127.38 67.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.075 0.464 . . . . 0.0 110.299 -177.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.487 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 91.8 t80 -119.56 100.59 7.37 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.495 -176.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.624 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 44.1 mt-30 -93.29 117.01 29.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.234 -175.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.47 HD11 ' CE2' ' A' ' 72' ' ' TYR . 16.7 mm -86.58 113.96 25.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.651 171.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.402 ' OG ' ' HD1' ' A' ' 45' ' ' TYR . 42.2 t -105.11 111.6 24.42 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.334 0.588 . . . . 0.0 110.781 179.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.521 HD13 ' N ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -102.74 39.3 1.55 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.548 177.047 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.482 ' HA ' HG12 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -50.31 -73.77 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 114.289 -1.323 . . . . 0.0 113.621 -173.697 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 124.94 -7.07 8.24 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 111.107 -0.797 . . . . 0.0 111.107 -172.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -142.34 119.12 11.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 20.9 tt0 -68.08 -41.74 81.46 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.955 -173.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 -79.9 -24.33 41.2 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -168.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -70.95 -48.83 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.569 ' CZ2' HD13 ' A' ' 23' ' ' LEU . 12.5 t90 -61.83 -47.07 86.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.891 176.238 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.915 ' HA ' HD12 ' A' ' 23' ' ' LEU . 60.3 tttt -62.13 -44.27 97.01 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.4 p -69.75 -41.09 75.67 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.91 0.386 . . . . 0.0 111.397 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.7 p -76.7 -42.79 40.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.857 -176.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.92 ' HB3' HD11 ' A' ' 23' ' ' LEU . . . -79.57 -24.63 41.96 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -171.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.4 ' N ' ' HG ' ' A' ' 23' ' ' LEU . 24.6 t70 -71.8 -8.78 56.34 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.506 0.67 . . . . 0.0 110.442 -178.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -101.8 9.94 40.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.119 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.862 ' HG ' ' O ' ' A' ' 87' ' ' ALA . 3.7 pp -98.44 158.2 33.03 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.968 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.764 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 32.5 Cg_endo -85.03 -3.06 9.66 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 124.062 3.174 . . . . 0.0 114.693 -172.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.835 ' CD1' HD13 ' A' ' 90' ' ' LEU . 2.4 p90 -122.55 -153.64 0.56 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -176.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.546 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 83.9 t -103.28 134.3 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -177.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.463 ' HB3' HD21 ' A' ' 23' ' ' LEU . 39.1 t -137.93 112.86 9.06 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.45 0.643 . . . . 0.0 109.539 176.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.468 ' CG2' ' HB2' ' A' ' 20' ' ' LEU . 27.4 m -114.6 148.07 17.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.896 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.478 ' HD2' ' CE3' ' A' ' 83' ' ' TRP . 36.1 ttt180 -100.24 137.49 38.61 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.92 0.391 . . . . 0.0 111.215 -174.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -87.09 146.01 26.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.265 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.64 -28.36 30.77 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.403 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 4.8 m-20 -91.53 -13.83 31.42 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -171.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 54.84 72.75 0.5 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.451 -0.404 . . . . 0.0 113.357 176.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.502 ' N ' ' HB2' ' A' ' 76' ' ' LEU . . . 78.2 -15.81 0.72 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.721 0.808 . . . . 0.0 111.858 177.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.54 25.24 5.89 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 172.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.443 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.9 OUTLIER -66.47 135.13 53.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.116 -176.393 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.616 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 26.2 m -55.65 -36.3 66.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.517 176.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.55 -46.12 84.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.191 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.5 HG23 ' HB ' ' A' ' 111' ' ' VAL . 65.8 mt -57.54 -43.48 83.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.753 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -67.59 -32.25 72.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.103 176.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 104' ' ' SER . 84.9 mt -65.7 -39.71 91.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.278 -179.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.423 ' O ' ' CB ' ' A' ' 110' ' ' ASN . 65.2 m-85 -77.12 -50.96 11.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.558 175.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.423 ' CB ' ' O ' ' A' ' 109' ' ' TYR . 8.6 t30 131.98 -43.31 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 O-C-N 125.525 1.766 . . . . 0.0 108.226 -176.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.5 ' HB ' HG23 ' A' ' 106' ' ' ILE . 0.4 OUTLIER 13.39 -86.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 O-C-N 125.428 1.705 . . . . 0.0 114.178 -174.298 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . 0.435 ' H ' ' HB ' ' A' ' 111' ' ' VAL . 31.1 m 70.98 -52.99 0.68 Allowed 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.76 -173.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -95.2 76.82 3.45 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 121.187 0.517 . . . . 0.0 111.985 -175.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.539 HD21 ' HB3' ' A' ' 42' ' ' PHE . 2.4 mp -74.88 162.8 71.99 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.615 168.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.401 ' HA ' ' CB ' ' A' ' 114' ' ' LEU . 4.9 Cg_exo -73.78 159.03 98.16 Favored 'Cis proline' 0 C--N 1.35 0.646 0 C-N-CA 123.249 -1.563 . . . . 0.0 112.053 0.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.8 m -145.81 175.76 10.17 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.567 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.9 p -143.11 155.12 17.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.648 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 93.3 m-85 -133.8 155.63 49.46 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.983 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 5.1 tp -118.41 143.93 46.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.318 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.735 HG12 ' HA ' ' A' ' 126' ' ' LEU . 14.5 m -138.99 140.15 39.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.078 0.466 . . . . 0.0 110.115 167.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.576 ' HB3' HD22 ' A' ' 143' ' ' LEU . 1.1 p-10 -89.49 178.29 6.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.859 -176.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.833 ' HD2' HG23 ' A' ' 37' ' ' VAL . 9.8 mmm180 -38.14 -48.2 1.22 Allowed 'General case' 0 N--CA 1.481 1.115 0 O-C-N 124.808 1.318 . . . . 0.0 113.813 -171.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -72.49 9.5 1.04 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.453 -176.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.665 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 1.6 t-20 54.28 57.95 5.4 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 123.594 0.758 . . . . 0.0 110.305 -171.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -128.09 140.15 52.11 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.325 -0.852 . . . . 0.0 108.716 178.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.735 ' HA ' HG12 ' A' ' 120' ' ' VAL . 3.8 tt -62.12 121.02 12.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.681 0.753 . . . . 0.0 111.295 -170.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.983 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 68.8 m -84.92 -54.58 4.57 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.531 -1.213 . . . . 0.0 111.436 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.497 ' HB1' ' OD1' ' A' ' 132' ' ' ASN . . . -168.98 173.6 6.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 -174.079 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.473 ' O ' HG13 ' A' ' 133' ' ' ILE . 89.7 mtt180 -110.58 158.83 18.14 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.805 -178.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -59.83 -14.99 32.71 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.06 173.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -72.25 -28.03 62.88 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 122.469 0.308 . . . . 0.0 111.033 176.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.497 ' OD1' ' HB1' ' A' ' 128' ' ' ALA . 24.6 p30 -127.57 -7.12 5.72 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -171.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.725 HG21 ' HG ' ' A' ' 136' ' ' LEU . 89.8 mt -78.8 108.63 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.564 ' HD2' ' H ' ' A' ' 134' ' ' LYS . 0.1 OUTLIER -58.42 -51.11 71.22 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.797 0.808 . . . . 0.0 110.009 178.122 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.557 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 9.8 t70 -154.38 124.91 6.99 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.137 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.725 ' HG ' HG21 ' A' ' 133' ' ' ILE . 5.7 mp -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.74 -174.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -48.55 -52.69 21.46 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 123.051 0.219 . . . . 0.0 111.409 174.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 135' ' ' ASP . 0.0 OUTLIER -69.66 -38.79 77.22 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.321 0.581 . . . . 0.0 111.542 -179.156 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.649 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -62.81 -53.2 57.97 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.854 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.549 HG13 ' O ' ' A' ' 136' ' ' LEU . 41.7 mt -62.0 -32.03 53.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.271 0.558 . . . . 0.0 110.397 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -58.8 -43.08 90.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.412 177.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? -84.65 -18.84 34.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.203 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 139' ' ' ALA . 30.8 mt -73.18 -41.84 63.4 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.779 -0.191 . . . . 0.0 111.25 178.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.583 HD11 ' HB3' ' A' ' 64' ' ' TYR . 21.1 mt -57.15 -49.72 75.07 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.434 0.635 . . . . 0.0 109.72 176.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -63.4 -53.35 53.74 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 114.374 -1.284 . . . . 0.0 111.454 179.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 85.25 98.22 0.7 Allowed Glycine 0 N--CA 1.441 -1.006 0 N-CA-C 110.647 -0.981 . . . . 0.0 110.647 -172.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . . . . . . . . . 64.5 t60 -66.12 -17.73 64.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.557 0.218 . . . . 0.0 111.465 -175.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 45.2 t60 -110.76 3.24 18.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.707 0.765 . . . . 0.0 109.542 174.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -92.16 -30.16 16.1 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 175.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -169.45 132.32 1.23 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 167.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -57.28 116.71 3.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.615 0.722 . . . . 0.0 111.986 -172.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 . . . . . 0 C--O 1.249 1.031 0 CA-C-N 115.228 -0.896 . . . . 0.0 108.839 174.787 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.0 mtm . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 110.426 -0.212 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.7 m 65.95 17.43 10.8 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.756 0.66 . . . . 0.0 111.474 174.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 36.0 mt -140.67 134.26 30.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.814 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -145.75 93.31 2.33 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 173.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 9.6 pt -115.47 133.79 22.71 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.334 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.516 ' HG2' ' HA ' ' A' ' 14' ' ' SER . 88.3 Cg_endo -85.83 24.29 0.77 Allowed 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 122.761 2.307 . . . . 0.0 112.014 178.337 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -119.28 80.97 1.64 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.342 174.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.89 -84.25 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.044 -176.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -133.05 -16.01 2.53 Favored 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.677 176.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 25.6 mm -131.27 156.84 43.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 114.152 -1.385 . . . . 0.0 109.365 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -63.3 104.96 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 173.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -153.62 103.74 2.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.897 0.38 . . . . 0.0 110.876 177.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 64.93 26.38 12.79 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.214 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.516 ' HA ' ' HG2' ' A' ' 6' ' ' PRO . 7.2 m -74.69 95.39 2.84 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 121.467 0.651 . . . . 0.0 110.413 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.805 HG13 ' HG ' ' A' ' 126' ' ' LEU . 12.1 tt -166.44 157.2 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.876 -179.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.488 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.6 mp -101.5 109.03 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 172.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.437 ' HA ' HD12 ' A' ' 30' ' ' LEU . 25.8 t0 -73.51 131.97 42.36 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.434 HG23 ' CZ ' ' A' ' 105' ' ' TYR . 7.3 mt -113.29 111.58 36.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.138 -175.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.552 ' HA ' ' O ' ' A' ' 28' ' ' ARG . 1.2 mp0 -98.87 100.16 11.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.296 178.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.5 mt -135.95 154.39 51.12 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 27' ' ' THR . 89.7 mttt -85.34 143.19 28.81 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.925 0.393 . . . . 0.0 110.854 -175.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.489 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 2.4 p-10 -76.68 -167.13 0.76 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.929 -178.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.651 HD11 ' HG3' ' A' ' 84' ' ' LYS . 36.9 tp -56.67 -36.32 69.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.127 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.406 ' HB2' HD22 ' A' ' 26' ' ' ASN . 66.0 mttm -79.66 -33.52 41.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.675 -178.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.457 ' O ' ' HD3' ' A' ' 21' ' ' LYS . . . 116.49 20.24 5.13 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.065 -177.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.406 HD22 ' HB2' ' A' ' 24' ' ' LYS . 36.3 m-80 -95.92 114.87 26.63 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 175.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.7 m -61.99 115.49 4.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.357 0.599 . . . . 0.0 111.182 178.024 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.552 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 18.8 mmm180 -92.27 142.1 27.84 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.501 175.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.5 p -120.1 159.5 24.7 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 172.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.607 ' HB3' HD21 ' A' ' 124' ' ' ASN . 71.7 mt -80.91 -28.79 35.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.689 0.281 . . . . 0.0 111.229 -177.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 p -71.87 0.64 8.63 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.97 0.414 . . . . 0.0 111.241 175.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -83.45 -50.34 8.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.667 177.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.567 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -98.73 26.02 6.02 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.854 0.835 . . . . 0.0 110.277 -176.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.622 ' HG3' ' HB2' ' A' ' 124' ' ' ASN . 30.3 ttpt -59.47 -26.57 65.35 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 113.976 -1.465 . . . . 0.0 112.514 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -56.5 -21.72 35.8 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 116.279 -0.419 . . . . 0.0 113.866 -176.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.615 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.0 OUTLIER -138.41 -169.66 2.64 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 116.859 0.329 . . . . 0.0 110.522 178.483 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.668 HG11 ' HB3' ' A' ' 143' ' ' LEU . 27.6 m -82.52 143.44 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 -176.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.551 HG22 ' HG ' ' A' ' 33' ' ' LEU . 21.5 t -119.98 137.89 52.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.975 -173.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.667 HD22 ' HZ ' ' A' ' 69' ' ' PHE . 12.7 tp -102.66 106.2 16.81 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.969 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.636 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 18.2 mm -84.74 106.47 14.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.558 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 5.1 t70 -108.42 135.08 50.31 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.705 0.288 . . . . 0.0 111.032 -175.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.539 ' HB3' HD11 ' A' ' 76' ' ' LEU . 59.8 m-85 -123.13 99.92 6.6 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.565 ' HA ' ' HB3' ' A' ' 115' ' ' PRO . 15.8 m -138.81 149.66 45.19 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.018 0.437 . . . . 0.0 111.847 -170.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 47' ' ' ASN . 13.7 m -96.13 115.71 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 121.178 0.513 . . . . 0.0 110.755 176.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.536 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 36.7 m-85 -78.73 85.4 4.74 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.576 0.703 . . . . 0.0 109.477 176.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 178.25 -34.69 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.829 -1.078 . . . . 0.0 109.352 -170.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.547 ' HB2' HG23 ' A' ' 44' ' ' VAL . 2.7 t-20 -84.04 163.45 19.89 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.698 -171.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.83 -30.4 40.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.339 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.6 tpt -62.5 -26.53 68.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.738 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 m -60.79 -34.13 74.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.141 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.64 -52.22 65.27 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.633 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.83 81.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.856 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.49 ' HE2' ' CG ' ' A' ' 41' ' ' ASP . 73.5 t60 -61.97 -51.57 67.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.81 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.572 ' HA ' HD12 ' A' ' 57' ' ' LEU . 5.0 m-20 -75.01 -18.01 60.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.589 -177.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 1.8 tm? -69.03 -51.34 40.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 172.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.02 -39.17 84.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.502 178.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.572 HD12 ' HA ' ' A' ' 54' ' ' ASN . 96.2 mt -60.65 -38.95 86.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.086 174.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 7.5 tpp180 -62.83 -27.83 69.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.563 179.128 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -78.13 -51.01 10.9 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.714 HD12 HD12 ' A' ' 140' ' ' ILE . 2.9 mm? -56.09 -32.27 63.99 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 112.735 -2.03 . . . . 0.0 111.07 177.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.503 ' CD1' ' HE3' ' A' ' 92' ' ' TRP . 30.5 t80 -70.21 -49.12 53.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.084 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -64.03 -21.41 66.5 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.654 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -84.05 -61.74 1.74 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.063 -177.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.515 ' HB3' HD11 ' A' ' 144' ' ' LEU . 84.9 m-85 -113.84 -18.2 11.86 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -166.023 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.47 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -69.57 161.5 29.45 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.004 -176.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.5 m 77.73 -34.76 0.2 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.529 0.732 . . . . 0.0 111.543 -177.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' A' ' 67' ' ' GLN . 1.6 mp0 -85.24 11.04 10.79 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.862 0.363 . . . . 0.0 111.068 177.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.612 ' O ' ' HB2' ' A' ' 36' ' ' LYS . . . 121.47 27.53 1.78 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.35 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.667 ' HZ ' HD22 ' A' ' 39' ' ' LEU . 56.2 t80 -134.98 130.06 35.17 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 176.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.615 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 3.0 tt0 -133.3 156.26 47.92 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.261 178.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.477 HD12 ' CE3' ' A' ' 92' ' ' TRP . 54.2 mt -120.78 131.6 72.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.391 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.498 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 66.2 t80 -121.17 101.02 7.39 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.09 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.558 ' HG3' ' HB3' ' A' ' 41' ' ' ASP . 7.3 tt0 -105.91 145.76 30.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.014 0.435 . . . . 0.0 111.052 -176.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.423 HD11 ' HE2' ' A' ' 72' ' ' TYR . 46.5 mt -126.51 127.58 70.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.959 -177.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.536 ' HB3' ' CD1' ' A' ' 45' ' ' TYR . 2.6 p -85.34 121.81 28.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.962 0.41 . . . . 0.0 110.955 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.58 ' HA ' ' HA2' ' A' ' 100' ' ' GLY . 12.1 mt -110.39 9.07 23.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.214 0.531 . . . . 0.0 110.387 -178.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.497 ' OD1' ' HB2' ' A' ' 75' ' ' SER . 1.0 OUTLIER -68.66 -68.71 0.38 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.05 -175.808 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.64 23.24 6.02 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 110.977 -0.849 . . . . 0.0 110.977 -174.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -134.57 98.85 4.18 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.523 ' HG2' ' CE3' ' A' ' 83' ' ' TRP . 25.8 mt-10 -75.35 -14.47 60.48 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.677 -176.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -50.87 66.78 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.002 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -81.78 -30.48 32.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.876 0.37 . . . . 0.0 110.225 -177.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.545 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 42.6 t90 -66.16 -52.0 52.48 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.097 175.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.651 ' HG3' HD11 ' A' ' 23' ' ' LEU . 19.1 ttmm -64.17 -43.47 95.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.934 -173.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 13.9 p -65.05 -43.24 92.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.666 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.428 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 38.1 t -74.46 -37.13 63.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.532 -178.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.566 ' HB3' HD13 ' A' ' 23' ' ' LEU . . . -69.91 -29.07 66.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -174.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.44 -23.02 66.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.305 0.574 . . . . 0.0 110.764 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -92.38 -8.18 45.62 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.83 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 86' ' ' SER . 34.8 mt -76.75 146.4 76.28 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.688 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 20.0 Cg_endo -91.25 -17.06 1.24 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 124.423 3.415 . . . . 0.0 113.523 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.688 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.4 p90 -115.93 -170.32 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.7 0.286 . . . . 0.0 110.94 -175.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.457 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 60.3 t -81.24 122.27 36.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.072 -176.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 49.8 t -125.8 109.31 12.39 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.957 178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.489 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 17.2 m -117.63 158.75 18.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.892 -178.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.463 ' HA ' ' OG ' ' A' ' 75' ' ' SER . 19.0 ttp180 -107.91 136.23 47.97 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.139 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -80.77 155.54 26.63 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.55 -20.46 36.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.763 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.513 ' HB2' ' HA ' ' A' ' 103' ' ' SER . 3.3 m-80 -122.19 -12.94 8.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.579 -173.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.58 ' HA2' ' HA ' ' A' ' 76' ' ' LEU . . . 70.97 -129.89 18.9 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.619 -0.8 . . . . 0.0 111.887 178.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.26 -5.63 29.05 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.851 0.357 . . . . 0.0 111.379 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -102.53 12.72 36.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.241 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.533 ' HB3' HG13 ' A' ' 106' ' ' ILE . 34.7 t -62.97 134.66 56.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.055 -177.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.505 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 8.0 m -61.26 -26.99 68.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.741 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.434 ' CZ ' HG23 ' A' ' 18' ' ' ILE . 64.1 m-85 -60.5 -45.09 95.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.611 178.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.533 HG13 ' HB3' ' A' ' 103' ' ' SER . 36.6 mt -61.15 -36.0 69.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.508 -177.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.6 m -68.16 -35.64 78.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.724 178.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 104' ' ' SER . 98.5 mt -65.06 -35.25 80.56 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.439 -178.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.422 ' OH ' HD11 ' A' ' 18' ' ' ILE . 93.4 m-85 -74.24 -20.43 60.17 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.145 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.465 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER 53.56 58.44 5.17 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -167.324 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 9.3 p -65.02 147.93 12.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.294 -1.321 . . . . 0.0 110.749 -176.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 10.5 m -86.95 -34.5 19.3 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.925 0.393 . . . . 0.0 110.927 178.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -170.42 166.19 8.54 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.659 HD23 ' HB2' ' A' ' 116' ' ' SER . 64.9 mt -142.46 159.08 59.11 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 177.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.565 ' HB3' ' HA ' ' A' ' 43' ' ' THR . 20.4 Cg_exo -67.4 147.24 77.81 Favored 'Cis proline' 0 C--N 1.352 0.723 0 C-N-CA 124.468 -1.055 . . . . 0.0 113.143 0.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.659 ' HB2' HD23 ' A' ' 114' ' ' LEU . 8.8 m -142.22 177.94 7.9 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.765 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.424 HG11 HD21 ' A' ' 136' ' ' LEU . 4.5 p -135.44 162.13 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.844 179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.636 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 63.9 m-85 -138.78 160.22 40.21 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 175.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.846 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.5 tp -110.44 139.0 46.08 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.621 -0.432 . . . . 0.0 110.473 -174.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.601 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 52.9 t -127.75 118.83 50.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.947 176.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.433 ' OD1' ' HB2' ' A' ' 125' ' ' GLU . 4.1 p-10 -76.75 162.63 27.52 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.987 176.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -69.78 27.82 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -167.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 121' ' ' ASN . 16.8 m120 -123.84 14.44 9.29 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 174.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.622 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . 2.6 t-20 53.24 61.66 3.04 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.684 -1.144 . . . . 0.0 110.168 -169.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 120' ' ' VAL . 68.6 mt-10 -130.88 150.74 51.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.175 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.805 ' HG ' HG13 ' A' ' 15' ' ' ILE . 24.7 mt -72.37 119.67 16.91 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.125 0.488 . . . . 0.0 110.103 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.846 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 35.5 m -83.42 -51.26 7.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.344 177.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -170.02 172.78 6.31 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.02 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.498 ' O ' HG13 ' A' ' 133' ' ' ILE . 82.0 mtm180 -103.16 158.39 16.34 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.404 -176.108 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -57.4 -35.82 73.78 Favored Glycine 0 C--O 1.228 -0.241 0 C-N-CA 121.565 -0.35 . . . . 0.0 112.892 -175.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.489 ' OE1' ' HB3' ' A' ' 129' ' ' ARG . 1.5 pm0 -77.61 -7.08 55.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.907 0.384 . . . . 0.0 111.117 178.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -105.0 -20.18 13.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.018 0.437 . . . . 0.0 110.2 178.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.732 HG21 ' HG ' ' A' ' 136' ' ' LEU . 60.5 mt -97.49 138.86 21.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.375 -176.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.59 1.07 4.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.088 0.471 . . . . 0.0 110.032 177.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -144.87 48.93 1.3 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.51 -168.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.732 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.9 mp -56.43 -38.91 72.24 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -176.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -55.41 -53.33 57.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.39 . . . . 0.0 110.031 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.517 ' HA ' ' HE2' ' A' ' 141' ' ' LYS . 66.0 mm-40 -62.72 -39.56 94.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.942 175.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 1.042 ' HA ' ' HE2' ' A' ' 142' ' ' LYS . . . -59.59 -56.9 16.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.648 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.714 HD12 HD12 ' A' ' 60' ' ' LEU . 52.0 mt -56.33 -42.37 73.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.378 0.609 . . . . 0.0 110.492 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 138' ' ' GLU . 18.5 ttpt -60.41 -42.43 95.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.447 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 1.042 ' HE2' ' HA ' ' A' ' 139' ' ' ALA . 36.5 pttt -80.24 -23.45 40.85 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 120.659 0.266 . . . . 0.0 111.036 -179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.668 ' HB3' HG11 ' A' ' 37' ' ' VAL . 82.5 mt -70.72 -40.54 72.73 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.715 176.321 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 140' ' ' ILE . 90.9 mt -56.41 -53.41 57.7 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.921 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.54 -56.2 11.92 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.909 178.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 147' ' ' HIS . . . 60.57 69.06 1.4 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.463 -0.875 . . . . 0.0 111.355 -177.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . 0.478 ' HB2' ' O ' ' A' ' 146' ' ' GLY . 77.6 m-70 76.14 -57.9 0.55 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.553 0.741 . . . . 0.0 111.082 -176.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -175.11 -64.53 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.835 0.35 . . . . 0.0 111.027 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -76.86 136.83 38.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.808 0.813 . . . . 0.0 113.148 -168.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -177.06 45.16 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 113.749 -1.568 . . . . 0.0 107.15 174.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 46.4 t60 62.55 54.67 2.38 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 114.149 -1.387 . . . . 0.0 107.696 -163.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 36.8 t60 . . . . . 0 C--O 1.249 1.075 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.226 -172.668 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 pmm? . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.4 p -150.04 -73.49 0.17 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.18 0.514 . . . . 0.0 109.82 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 95.3 mt -130.76 142.87 50.43 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.226 174.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -87.12 105.11 16.96 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 61.2 mt -120.57 133.91 24.12 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.694 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.707 ' HG3' ' HB3' ' A' ' 13' ' ' ALA . 65.2 Cg_exo -48.97 159.8 0.86 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.141 2.561 . . . . 0.0 112.912 175.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -104.76 -41.36 5.68 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.727 -170.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.421 ' OD1' ' HG3' ' A' ' 9' ' ' LYS . 2.8 p30 -163.99 12.54 0.05 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.421 ' HG3' ' OD1' ' A' ' 8' ' ' ASP . 24.5 mttp -132.08 163.77 27.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.183 0.516 . . . . 0.0 110.378 178.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 pt -101.26 147.38 8.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 170.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 11' ' ' LYS . 26.1 ttpp 68.98 15.29 8.85 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.511 0.672 . . . . 0.0 110.927 177.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -95.55 -7.09 38.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.671 0.748 . . . . 0.0 109.752 175.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.707 ' HB3' ' HG3' ' A' ' 6' ' ' PRO . . . -177.42 -25.63 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.012 -1.449 . . . . 0.0 109.634 -176.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.77 -41.35 73.91 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.254 175.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.4 tp -169.15 138.03 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.122 178.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.496 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.9 mp -101.16 105.39 17.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 176.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -76.11 111.07 11.13 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.257 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.4 HG22 ' HG ' ' A' ' 20' ' ' LEU . 13.2 mt -108.4 130.44 61.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.945 -177.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.541 ' HG3' ' HB3' ' A' ' 29' ' ' SER . 12.8 mp0 -111.56 100.7 9.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.746 0.308 . . . . 0.0 110.514 -178.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.4 ' HG ' HG22 ' A' ' 18' ' ' ILE . 50.4 mt -130.06 154.64 47.23 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.509 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 92.8 mttt -88.79 146.57 24.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.859 0.362 . . . . 0.0 110.804 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.747 ' OD2' ' HG2' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -85.45 -172.47 4.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 179.777 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.54 HD11 ' HG3' ' A' ' 84' ' ' LYS . 55.3 tp -51.43 -36.51 44.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.931 177.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.747 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 25.9 mmtm -72.79 -43.13 63.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.473 0.654 . . . . 0.0 110.012 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 125.62 11.16 4.17 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.665 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.539 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 39.6 m-80 -83.43 113.33 20.69 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 178.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.509 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 16.1 m -64.55 107.35 1.37 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.118 0.485 . . . . 0.0 110.02 173.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.519 ' O ' ' HA ' ' A' ' 19' ' ' GLN . 17.6 mmm180 -93.02 138.57 31.37 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.163 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.541 ' HB3' ' HG3' ' A' ' 19' ' ' GLN . 2.9 p -118.29 154.18 32.72 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 16' ' ' ILE . 82.3 mt -77.37 -30.98 54.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.853 0.358 . . . . 0.0 110.738 -176.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.5 t -74.89 0.24 16.27 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.141 0.496 . . . . 0.0 110.67 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -87.97 -51.23 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.446 ' O ' ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -85.17 12.38 8.02 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 122.057 0.932 . . . . 0.0 110.644 -176.455 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.45 ' HD3' ' HB2' ' A' ' 124' ' ' ASN . 25.9 ttpp -56.27 124.08 16.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.728 169.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.71 -40.12 1.17 Allowed Glycine 0 CA--C 1.495 -1.217 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -172.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HB2' ' C ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -119.27 173.67 6.8 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 172.592 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.641 HG23 ' HD1' ' A' ' 69' ' ' PHE . 17.1 m -75.87 136.37 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.947 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.416 HG22 ' HG ' ' A' ' 33' ' ' LEU . 33.0 t -116.76 123.69 71.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.94 -171.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.626 ' HB3' HG23 ' A' ' 71' ' ' ILE . 10.5 tp -87.17 112.7 22.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.751 175.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.612 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 16.3 mm -87.36 105.08 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.593 ' HB3' ' HA ' ' A' ' 73' ' ' GLN . 18.1 t70 -109.65 134.88 51.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.761 0.315 . . . . 0.0 111.033 -175.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.549 ' HB3' HD13 ' A' ' 114' ' ' LEU . 61.7 m-85 -122.35 99.1 6.24 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 176.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.899 ' O ' ' HA ' ' A' ' 75' ' ' SER . 20.6 m -139.71 143.68 37.17 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.107 0.48 . . . . 0.0 111.5 -169.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.695 HG13 ' HB2' ' A' ' 47' ' ' ASN . 3.4 p -96.81 120.96 46.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 O-C-N 121.978 -0.451 . . . . 0.0 110.138 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.599 ' CD1' ' HB3' ' A' ' 75' ' ' SER . 48.3 m-85 -77.22 79.38 3.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.749 0.785 . . . . 0.0 109.46 176.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -178.75 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 113.884 -1.507 . . . . 0.0 109.112 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.695 ' HB2' HG13 ' A' ' 44' ' ' VAL . 38.5 t-20 -65.41 140.43 58.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.627 -179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.89 -35.43 80.63 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.484 -177.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -67.85 -19.89 65.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.065 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.9 m -68.03 -29.09 67.99 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.138 -178.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.6 -55.58 16.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.832 0.349 . . . . 0.0 110.851 -178.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.07 86.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.181 0.515 . . . . 0.0 110.711 178.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.623 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 72.1 t60 -61.58 -38.99 89.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.952 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.49 ' HA ' HD12 ' A' ' 57' ' ' LEU . 21.7 t-20 -68.73 -30.33 68.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.544 0.211 . . . . 0.0 110.712 -179.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 tt -69.74 -41.84 74.73 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.27 80.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.388 176.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' A' ' 53' ' ' HIS . 76.6 mt -67.98 -39.44 83.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.481 176.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 58' ' ' ARG . 2.0 tpp180 -60.67 -33.44 72.83 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.867 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -73.13 -52.96 12.28 Favored 'General case' 0 CA--C 1.493 -1.237 0 CA-C-O 122.743 1.258 . . . . 0.0 108.08 -173.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.86 HD12 HD12 ' A' ' 140' ' ' ILE . 2.3 mm? -55.76 -31.7 62.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 112.219 -2.264 . . . . 0.0 110.888 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -75.25 -50.12 17.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.894 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -61.15 -22.03 64.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.529 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -81.67 -60.74 2.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.077 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -104.66 -7.69 19.43 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -166.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.544 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -67.88 165.8 16.88 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.491 -0.483 . . . . 0.0 111.169 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 56.9 m 70.89 -10.95 0.69 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.779 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -105.18 3.44 30.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.956 0.408 . . . . 0.0 110.729 179.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.546 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 114.3 45.73 0.66 Allowed Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 -176.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.641 ' HD1' HG23 ' A' ' 37' ' ' VAL . 83.1 t80 -138.25 130.43 28.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.874 0.369 . . . . 0.0 110.822 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.44 ' HB3' ' HD3' ' A' ' 36' ' ' LYS . 22.4 tt0 -144.95 157.32 44.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.006 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.626 HG23 ' HB3' ' A' ' 39' ' ' LEU . 58.2 mt -127.45 136.43 60.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.305 -171.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.558 ' HA ' ' HB ' ' A' ' 93' ' ' VAL . 50.0 t80 -123.52 102.1 7.69 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.499 -178.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.593 ' HA ' ' HB3' ' A' ' 41' ' ' ASP . 35.1 mt-30 -93.74 141.97 27.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 111.578 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.5 mt -122.26 122.17 65.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.038 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.899 ' HA ' ' O ' ' A' ' 43' ' ' THR . 78.7 p -99.73 142.01 31.78 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -175.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.747 HD11 HD12 ' A' ' 114' ' ' LEU . 81.5 mt -110.71 31.54 5.91 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.249 0.547 . . . . 0.0 109.565 172.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.558 ' HA ' HG23 ' A' ' 44' ' ' VAL . 5.3 p-10 -73.1 144.64 46.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.184 -173.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -108.31 16.7 34.97 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 164.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -125.69 94.6 4.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.151 -1.024 . . . . 0.0 109.278 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.416 ' HG2' ' HE3' ' A' ' 84' ' ' LYS . 32.0 tt0 -72.89 -27.06 61.66 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.227 -175.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 -72.68 -32.85 66.12 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.766 -174.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -79.09 -40.53 30.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.535 ' HD1' ' CD1' ' A' ' 45' ' ' TYR . 39.9 t90 -61.11 -48.92 79.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.632 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.54 ' HG3' HD11 ' A' ' 23' ' ' LEU . 35.9 ttmt -62.46 -44.36 96.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.887 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 p -75.19 -34.25 61.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.359 . . . . 0.0 111.633 -177.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.641 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 21.8 t -73.04 -44.99 60.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.449 ' HB1' ' SG ' ' A' ' 94' ' ' CYS . . . -67.55 -24.52 65.54 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.208 -178.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -63.39 -38.41 91.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.43 0.633 . . . . 0.0 109.709 176.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -93.99 11.41 29.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.969 -177.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 86' ' ' SER . 20.1 mt -97.64 133.68 23.29 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-O 121.535 0.683 . . . . 0.0 112.294 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.648 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 57.7 Cg_endo -80.45 -31.55 1.55 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 124.312 3.341 . . . . 0.0 113.071 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.648 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 4.8 p90 -100.77 -167.0 1.37 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.967 -173.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.558 ' HB ' ' HA ' ' A' ' 72' ' ' TYR . 54.1 t -81.68 132.72 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.782 -175.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.449 ' SG ' ' HB1' ' A' ' 87' ' ' ALA . 0.9 OUTLIER -136.65 100.04 4.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.062 179.4 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.624 ' HA ' ' HA ' ' A' ' 22' ' ' ASP . 14.5 m -114.87 151.25 16.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.474 -175.336 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -107.88 137.44 45.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 0.0 111.882 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -92.14 135.43 33.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.036 174.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.77 -4.34 57.81 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -94.6 -14.78 24.63 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.721 -174.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 49.36 66.5 2.2 Favored Glycine 0 CA--C 1.521 0.452 0 C-N-CA 121.488 -0.387 . . . . 0.0 113.838 174.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.565 ' H ' HD22 ' A' ' 76' ' ' LEU . . . 77.55 -5.17 2.18 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.414 0.685 . . . . 0.0 112.845 175.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -101.01 12.91 36.8 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 172.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.467 ' HB2' HG13 ' A' ' 106' ' ' ILE . 0.7 OUTLIER -61.96 126.59 27.89 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.89 -175.77 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.6 m -55.41 -28.88 56.96 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.372 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -61.3 -38.93 88.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.842 178.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.494 HG23 ' HB ' ' A' ' 111' ' ' VAL . 71.9 mt -59.66 -35.06 57.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.839 -178.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.7 m -73.86 -27.6 61.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.929 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.84 -37.81 67.31 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.089 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.788 ' HB2' HG23 ' A' ' 111' ' ' VAL . 91.7 m-85 -77.34 -8.51 57.78 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 121.135 -0.226 . . . . 0.0 110.598 178.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.49 HD22 ' C ' ' A' ' 110' ' ' ASN . 0.2 OUTLIER 54.96 51.71 13.1 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -169.653 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.788 HG23 ' HB2' ' A' ' 109' ' ' TYR . 94.1 t -69.5 128.52 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.024 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.815 -179.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 16.8 p -73.17 -48.48 35.0 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.495 177.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -176.5 135.53 0.24 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.794 176.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.747 HD12 HD11 ' A' ' 76' ' ' LEU . 72.1 mt -89.1 166.36 22.21 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.064 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.671 ' HA ' ' HB3' ' A' ' 114' ' ' LEU . 14.2 Cg_exo -69.35 159.44 88.4 Favored 'Cis proline' 0 C--N 1.354 0.833 0 C-N-CA 124.597 -1.001 . . . . 0.0 113.802 1.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 67.9 m -153.07 174.41 14.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.739 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.9 p -142.15 155.71 19.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.612 ' HB2' ' HB ' ' A' ' 40' ' ' ILE . 71.3 m-85 -136.02 161.88 34.44 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.792 ' HB3' ' HB2' ' A' ' 127' ' ' SER . 12.2 tp -111.76 133.48 53.96 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 -176.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 125' ' ' GLU . 4.2 t -131.29 128.41 61.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.854 0.359 . . . . 0.0 110.322 174.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.558 ' HB3' HD22 ' A' ' 143' ' ' LEU . 10.1 p30 -90.79 174.6 7.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.245 178.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -54.17 -23.23 13.58 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -166.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.54 ' HB2' ' HG3' ' A' ' 125' ' ' GLU . 28.0 m-20 -83.82 9.86 10.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.649 0.261 . . . . 0.0 110.513 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.45 ' HB2' ' HD3' ' A' ' 34' ' ' LYS . 1.5 t-20 64.79 35.74 8.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.978 -174.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.54 ' HG3' ' HB2' ' A' ' 123' ' ' ASN . 43.9 mt-10 -109.48 138.04 46.43 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.025 -176.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.85 112.8 3.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.675 0.75 . . . . 0.0 110.85 176.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.792 ' HB2' ' HB3' ' A' ' 119' ' ' LEU . 45.7 m -78.01 -55.65 5.12 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.621 178.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.22 14.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.956 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.644 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 0.2 OUTLIER -99.31 159.37 15.05 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.218 178.649 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -55.69 -46.18 83.05 Favored Glycine 0 CA--C 1.521 0.435 0 C-N-CA 121.613 -0.327 . . . . 0.0 113.64 -175.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.644 ' OE2' ' HB3' ' A' ' 129' ' ' ARG . 0.0 OUTLIER -71.78 -29.66 64.72 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.261 0.553 . . . . 0.0 110.018 179.765 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.459 ' N ' HD22 ' A' ' 132' ' ' ASN . 0.9 OUTLIER -68.33 -39.53 81.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.613 177.318 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.826 HG21 ' HG ' ' A' ' 136' ' ' LEU . 75.3 mt -70.71 147.36 11.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.535 178.33 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HE3' ' HB3' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -140.71 108.5 5.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 171.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.488 ' OD1' ' HB3' ' A' ' 137' ' ' ASP . 15.7 t70 67.7 102.31 0.05 OUTLIER 'General case' 0 C--O 1.233 0.202 0 O-C-N 124.432 1.083 . . . . 0.0 109.867 -168.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.826 ' HG ' HG21 ' A' ' 133' ' ' ILE . 3.8 mp -75.13 -22.24 58.31 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.69 -177.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.488 ' HB3' ' OD1' ' A' ' 135' ' ' ASP . 9.7 t70 -52.73 -53.87 41.73 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.18 175.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.654 ' HB3' ' HE2' ' A' ' 142' ' ' LYS . 33.1 mm-40 -56.98 -50.4 72.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.331 173.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -53.89 -54.27 41.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.174 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.86 HD12 HD12 ' A' ' 60' ' ' LEU . 31.0 mt -67.11 -33.54 63.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.043 0.449 . . . . 0.0 110.928 -177.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 6.0 ttpm? -65.21 -32.78 74.63 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.402 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.654 ' HE2' ' HB3' ' A' ' 138' ' ' GLU . 54.1 mttm -80.46 -20.45 43.73 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.95 177.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.558 HD22 ' HB3' ' A' ' 121' ' ' ASN . 65.5 mt -73.6 -43.05 60.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.901 177.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 91.9 mt -63.77 -42.48 97.78 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.575 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -76.35 -15.0 60.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.411 177.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.69 61.2 3.66 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.045 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . 0.557 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 18.6 p-80 -68.47 96.78 0.71 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.422 0.63 . . . . 0.0 110.212 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -64.73 -34.27 77.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.372 -174.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -165.26 19.4 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.338 0.59 . . . . 0.0 110.644 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.557 ' O ' ' HB2' ' A' ' 147' ' ' HIS . 97.3 m-70 -135.1 -159.82 0.99 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 28.7 m80 -104.81 -174.54 2.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 169.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.046 -0.978 . . . . 0.0 111.202 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 ptm . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -100.1 157.97 16.18 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 123.392 0.432 . . . . 0.0 110.356 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.444 ' HG ' HG12 ' A' ' 5' ' ' ILE . 41.5 tp -178.01 -29.51 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -178.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 56.66 50.94 11.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.257 173.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.444 HG12 ' HG ' ' A' ' 3' ' ' LEU . 47.1 mm -108.18 87.59 4.08 Favored Pre-proline 0 C--N 1.32 -0.691 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 169.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.53 165.03 6.47 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.044 2.496 . . . . 0.0 113.009 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.528 ' C ' ' H ' ' A' ' 9' ' ' LYS . 1.1 pt-20 -137.05 25.83 2.99 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.254 -0.884 . . . . 0.0 109.441 -177.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -69.48 25.43 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.079 -175.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.565 ' HA ' ' CG ' ' A' ' 12' ' ' GLU . 27.5 mmtm 65.66 -156.34 0.27 Allowed 'General case' 0 C--O 1.234 0.276 0 C-N-CA 123.417 0.687 . . . . 0.0 110.7 175.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.9 mt 71.7 -71.23 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-O 121.415 0.626 . . . . 0.0 109.758 -171.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 11' ' ' LYS . 23.9 mmtp -136.46 0.14 2.48 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.048 172.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.565 ' CG ' ' HA ' ' A' ' 9' ' ' LYS . 47.4 mt-10 50.16 31.91 5.49 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.001 -0.999 . . . . 0.0 112.621 177.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -162.42 29.0 0.11 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.777 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.7 m -154.35 156.02 36.14 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.45 ' HB ' ' HA ' ' A' ' 125' ' ' GLU . 10.3 tt -52.77 152.7 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.913 175.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.674 ' H ' HD12 ' A' ' 16' ' ' ILE . 3.9 mp -74.75 103.79 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 173.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.79 108.17 9.63 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.1 mt -100.76 116.92 45.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.119 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.578 ' HG2' ' HB3' ' A' ' 29' ' ' SER . 78.7 mt-30 -107.85 101.48 10.76 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.192 0.52 . . . . 0.0 110.82 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.838 ' HB2' HG11 ' A' ' 95' ' ' VAL . 29.6 mt -138.87 162.1 35.65 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.536 ' HG2' ' OG1' ' A' ' 27' ' ' THR . 51.8 mttm -94.25 150.06 20.65 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.344 0.592 . . . . 0.0 111.435 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.57 ' HA ' ' HA ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -81.24 -170.26 2.66 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.558 177.213 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.645 HD11 ' HE2' ' A' ' 84' ' ' LYS . 44.7 tp -54.82 -39.69 68.78 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.723 177.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB2' ' ND2' ' A' ' 26' ' ' ASN . 52.8 mttp -78.04 -26.95 48.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.445 -176.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 114.54 11.49 11.61 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.114 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.482 ' ND2' ' HB2' ' A' ' 24' ' ' LYS . 36.4 m-80 -82.79 110.45 17.83 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.536 ' OG1' ' HG2' ' A' ' 21' ' ' LYS . 21.3 m -68.27 113.55 5.98 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.521 ' HB2' ' HE1' ' A' ' 72' ' ' TYR . 13.6 mmm180 -103.42 139.58 38.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 178.037 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.578 ' HB3' ' HG2' ' A' ' 19' ' ' GLN . 82.4 p -120.48 160.3 23.42 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.585 HD12 ' O ' ' A' ' 16' ' ' ILE . 63.4 mt -80.55 -25.29 38.7 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.745 178.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.7 p -66.49 -20.17 65.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 173.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -79.28 -40.86 29.44 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 122.232 1.015 . . . . 0.0 108.476 175.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 tp -78.29 6.26 8.64 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.824 -1.534 . . . . 0.0 110.879 -177.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.729 ' HA ' ' HB2' ' A' ' 124' ' ' ASN . 21.5 ttmm -73.96 114.96 12.85 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.344 -177.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 142.61 -25.41 2.29 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -173.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.653 ' HE3' ' HB2' ' A' ' 70' ' ' GLU . 0.5 OUTLIER -117.77 168.24 10.64 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.438 175.75 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.756 HG23 ' HD1' ' A' ' 69' ' ' PHE . 29.4 m -82.92 124.58 39.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 173.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.68 ' HB ' ' CG2' ' A' ' 120' ' ' VAL . 72.3 t -113.05 136.92 47.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.565 0.698 . . . . 0.0 112.101 -168.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 39' ' ' LEU . 9.4 tp -98.99 119.18 37.33 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.624 177.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.407 ' HB ' ' HB2' ' A' ' 118' ' ' PHE . 0.2 OUTLIER -97.12 104.37 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 176.903 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -107.68 135.0 49.84 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.613 ' O ' ' HA ' ' A' ' 115' ' ' PRO . 82.9 m-85 -119.04 101.62 8.16 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 75' ' ' SER . 1.1 t -128.63 -178.21 4.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.186 -172.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.67 HG13 ' HB3' ' A' ' 47' ' ' ASN . 0.4 OUTLIER -135.79 117.6 20.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.265 177.456 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.501 ' OH ' HD11 ' A' ' 90' ' ' LEU . 32.0 m-85 -78.64 80.07 5.03 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.546 0.689 . . . . 0.0 110.689 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t30 -179.67 -35.47 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 113.816 -1.538 . . . . 0.0 108.757 173.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.67 ' HB3' HG13 ' A' ' 44' ' ' VAL . 4.6 t30 -77.51 132.71 38.51 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.351 -1.295 . . . . 0.0 110.562 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.05 -26.68 68.36 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.475 -173.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.91 -32.5 72.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.304 0.573 . . . . 0.0 109.603 -179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.3 m -68.22 -27.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.733 -178.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.09 -54.1 43.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.743 0.306 . . . . 0.0 111.042 -177.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.87 -34.09 76.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.109 0.48 . . . . 0.0 110.796 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.45 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 76.5 t60 -64.31 -38.75 92.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.578 ' HA ' HD12 ' A' ' 57' ' ' LEU . 6.2 m-20 -70.89 -18.83 62.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.615 -179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 58' ' ' ARG . 2.2 tt -77.18 -41.75 40.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.025 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.48 -37.76 82.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.373 0.606 . . . . 0.0 109.814 175.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.578 HD12 ' HA ' ' A' ' 54' ' ' ASN . 82.3 mt -65.36 -38.6 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.684 176.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.413 ' HA ' ' CZ3' ' A' ' 92' ' ' TRP . 5.9 tpp180 -61.89 -30.34 70.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.001 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -77.42 -51.61 10.5 Favored 'General case' 0 CA--C 1.494 -1.203 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -174.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 140' ' ' ILE . 1.8 mm? -56.14 -29.79 61.24 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 112.675 -2.057 . . . . 0.0 111.625 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -78.71 -46.34 19.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.085 -177.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -62.35 -22.48 66.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.545 0.688 . . . . 0.0 110.68 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -82.86 -61.06 1.97 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.129 -0.941 . . . . 0.0 112.329 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.578 ' HB3' HD11 ' A' ' 144' ' ' LEU . 92.9 m-85 -112.24 -5.64 14.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -162.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.581 ' HA ' ' HB3' ' A' ' 69' ' ' PHE . . . -59.04 -36.94 75.87 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 112.3 0.482 . . . . 0.0 112.3 -175.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.5 m -70.22 -5.74 29.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.593 ' HB2' HD13 ' A' ' 144' ' ' LEU . 45.3 mt-30 -110.64 12.91 22.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.007 0.432 . . . . 0.0 111.292 -178.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.474 ' O ' HG22 ' A' ' 37' ' ' VAL . . . 100.98 52.35 1.1 Allowed Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.786 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.756 ' HD1' HG23 ' A' ' 37' ' ' VAL . 43.3 t80 -131.12 134.34 46.47 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.653 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 10.6 tp10 -137.74 144.61 41.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.516 -177.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.426 HD12 ' CE3' ' A' ' 92' ' ' TRP . 60.3 mt -109.29 125.65 66.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.184 0.516 . . . . 0.0 110.426 177.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.521 ' HE1' ' HB2' ' A' ' 28' ' ' ARG . 85.6 t80 -111.0 102.02 10.53 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.54 -0.755 . . . . 0.0 108.974 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -95.31 134.45 38.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.252 -174.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.554 HD12 ' CE2' ' A' ' 42' ' ' PHE . 43.2 mt -120.11 112.16 35.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 0.0 110.059 174.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.418 ' HB2' ' CD1' ' A' ' 45' ' ' TYR . 30.1 t -91.11 140.66 29.61 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.7 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.645 HD11 HD12 ' A' ' 114' ' ' LEU . 16.6 mt -93.48 13.62 21.21 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.429 ' CG ' ' H ' ' A' ' 78' ' ' GLY . 5.2 p-10 44.13 -111.33 0.21 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.366 -1.288 . . . . 0.0 113.393 178.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.429 ' H ' ' CG ' ' A' ' 77' ' ' ASP . . . 92.75 -29.13 8.21 Favored Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 -170.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -142.73 119.51 11.19 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -72.58 -30.27 64.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.55 -176.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -67.48 -57.07 7.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.391 -174.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -66.02 -38.31 88.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.397 -174.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.509 ' CH2' ' HA ' ' A' ' 23' ' ' LEU . 36.1 t90 -62.42 -48.11 81.11 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.645 ' HE2' HD11 ' A' ' 23' ' ' LEU . 3.2 ttmt -58.11 -54.89 41.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.488 -174.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 18.2 p -66.03 -33.74 76.49 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.916 -0.583 . . . . 0.0 112.194 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.532 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 23.2 t -83.38 -32.8 25.99 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.869 -0.333 . . . . 0.0 111.458 -177.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.422 ' HB3' HD22 ' A' ' 23' ' ' LEU . . . -75.82 -35.0 60.15 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.503 ' HB2' ' CD2' ' A' ' 23' ' ' LEU . 19.0 t70 -70.34 -28.46 65.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.035 -176.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -94.08 16.43 14.62 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.482 -177.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' ' 94' ' ' CYS . 16.5 mt -88.71 148.32 41.42 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.36 0.6 . . . . 0.0 112.166 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.702 ' HG2' ' CE3' ' A' ' 92' ' ' TRP . 83.6 Cg_endo -76.04 -37.71 1.45 Allowed 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.693 2.929 . . . . 0.0 113.03 177.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.702 ' CE3' ' HG2' ' A' ' 91' ' ' PRO . 10.9 p90 -104.58 -167.91 1.41 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.778 -175.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.433 ' CG1' ' HG3' ' A' ' 28' ' ' ARG . 38.4 t -82.4 125.2 39.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.608 -175.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.572 ' HB2' HD12 ' A' ' 90' ' ' LEU . 30.8 t -121.91 108.78 13.84 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.241 0.543 . . . . 0.0 109.977 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.838 HG11 ' HB2' ' A' ' 20' ' ' LEU . 14.1 t -114.58 162.01 12.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.288 -172.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.438 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . 44.0 ttp180 -128.44 137.24 51.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.812 0.339 . . . . 0.0 111.277 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -87.94 145.97 25.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.57 -24.64 45.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.089 0.471 . . . . 0.0 111.357 -176.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -123.54 32.18 5.7 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.917 -176.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.489 ' O ' ' HB3' ' A' ' 76' ' ' LEU . . . -57.76 82.62 0.01 OUTLIER Glycine 0 C--N 1.342 0.876 0 O-C-N 123.757 0.66 . . . . 0.0 114.129 -173.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 167.24 -33.9 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 124.544 1.138 . . . . 0.0 108.561 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.92 12.07 5.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.97 -179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.52 ' HB3' HG13 ' A' ' 106' ' ' ILE . 41.9 t -62.99 135.85 57.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.604 -177.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.56 ' O ' ' HG ' ' A' ' 108' ' ' LEU . 13.3 m -54.99 -37.24 66.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.13 -176.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -56.84 -56.48 21.07 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.301 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.769 HG22 HG11 ' A' ' 111' ' ' VAL . 11.5 mt -58.61 -33.74 49.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.664 -175.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 18.6 m -71.01 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.427 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 104' ' ' SER . 94.6 mt -64.55 -34.96 79.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.751 0.31 . . . . 0.0 110.977 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -77.69 -4.11 44.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.895 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 1.4 t30 56.46 65.88 1.32 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.883 0.849 . . . . 0.0 109.728 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.769 HG11 HG22 ' A' ' 106' ' ' ILE . 2.7 p -73.41 122.95 27.38 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.437 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 5.8 m -126.35 0.23 7.0 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.458 0.647 . . . . 0.0 109.64 173.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.404 ' O ' HD23 ' A' ' 114' ' ' LEU . 6.8 t30 -169.5 119.72 0.67 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.471 -178.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.645 HD12 HD11 ' A' ' 76' ' ' LEU . 36.2 mt -124.76 157.69 65.13 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 171.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.613 ' HA ' ' O ' ' A' ' 42' ' ' PHE . 43.6 Cg_endo -68.25 150.16 85.55 Favored 'Cis proline' 0 C--N 1.347 0.462 0 C-N-CA 123.84 -1.317 . . . . 0.0 114.234 1.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 13.1 m -136.44 164.35 28.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.207 174.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 p -133.7 152.45 34.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.048 0.452 . . . . 0.0 110.68 -176.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.469 ' CE2' ' HG3' ' A' ' 129' ' ' ARG . 71.5 m-85 -133.77 152.1 51.78 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.356 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.633 HD13 HD11 ' A' ' 136' ' ' LEU . 35.4 tp -111.85 142.98 43.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.68 ' CG2' ' HB ' ' A' ' 38' ' ' VAL . 4.6 m -136.56 146.3 28.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 169.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.407 HD21 ' HB2' ' A' ' 125' ' ' GLU . 10.0 p30 -83.38 171.91 13.02 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -177.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 36' ' ' LYS . 8.9 ptp180 -65.16 -11.81 44.38 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -168.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -80.55 6.48 12.38 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 172.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.729 ' HB2' ' HA ' ' A' ' 34' ' ' LYS . 2.2 t-20 56.21 53.88 8.43 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.988 -173.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.45 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 75.1 mm-40 -129.98 143.95 51.07 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.625 177.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.646 ' HA ' HG12 ' A' ' 120' ' ' VAL . 2.6 tt -57.07 119.33 6.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.284 0.564 . . . . 0.0 110.954 -172.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.86 -51.84 5.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.161 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -169.51 171.56 7.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -176.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.571 ' O ' HG13 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -99.09 163.83 12.41 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 176.638 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.411 ' HA2' HD12 ' A' ' 133' ' ' ILE . . . -44.42 -42.52 7.2 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 114.925 0.73 . . . . 0.0 114.925 -175.134 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -41.42 34.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 117.27 0.535 . . . . 0.0 110.948 -177.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -63.48 -27.97 69.64 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.167 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.833 HG21 HD22 ' A' ' 136' ' ' LEU . 90.0 mt -68.24 -33.28 59.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.604 178.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.602 ' NZ ' ' HB2' ' A' ' 134' ' ' LYS . 5.1 mtmp? 72.09 -55.3 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.444 0.698 . . . . 0.0 110.263 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -154.47 124.68 6.84 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.017 -0.992 . . . . 0.0 108.508 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.833 HD22 HG21 ' A' ' 133' ' ' ILE . 0.1 OUTLIER -66.98 -42.98 84.16 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.678 -173.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.55 ' HA ' HD11 ' A' ' 60' ' ' LEU . 10.0 t70 -52.14 -51.28 58.92 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.107 0.479 . . . . 0.0 109.961 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.28 -50.54 50.09 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.015 -0.993 . . . . 0.0 112.4 175.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.494 ' O ' ' HG ' ' A' ' 143' ' ' LEU . . . -71.6 -46.81 58.14 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.829 -173.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.873 HD12 HD12 ' A' ' 60' ' ' LEU . 36.4 mt -59.04 -36.52 62.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.018 0.437 . . . . 0.0 110.379 179.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.1 tttm -59.35 -49.47 77.68 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.451 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -75.51 -21.53 57.92 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.711 -178.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.559 ' HB3' HG11 ' A' ' 37' ' ' VAL . 86.2 mt -69.59 -40.36 76.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.333 0.587 . . . . 0.0 110.436 175.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.593 HD13 ' HB2' ' A' ' 67' ' ' GLN . 73.2 mt -81.96 -55.74 4.4 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.253 179.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.408 ' HA ' ' OE1' ' A' ' 145' ' ' GLU . 6.4 mm-40 -77.13 1.63 17.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.042 -175.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -65.67 -45.45 89.11 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.199 172.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' HIS . . . . . 0.447 ' HB2' ' O ' ' A' ' 150' ' ' HIS . 96.9 m-70 62.15 -0.45 0.48 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 173.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' HIS . . . . . . . . . . . . . 43.1 t-80 69.27 -74.73 0.08 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.483 0.713 . . . . 0.0 112.642 171.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -104.96 4.32 31.66 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.28 0.562 . . . . 0.0 110.81 -174.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' HIS . . . . . 0.447 ' O ' ' HB2' ' A' ' 147' ' ' HIS . 18.2 m-70 -145.15 176.54 9.45 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 173.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -135.11 177.01 8.14 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 118.138 0.426 . . . . 0.0 110.413 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 . . . . . 0 C--O 1.244 0.781 0 CA-C-O 118.407 -0.806 . . . . 0.0 109.214 175.002 . . . . . . . . 0 0 . 1 stop_ save_